Organic acids and derivatives
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2-Ethylhexyl methacrylate, 99%, stabilized
CAS: 688-84-6 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00009494 InChI Key: WDQMWEYDKDCEHT-UHFFFAOYSA-N Synonym: 2-ethylhexyl methacrylate,2-ethyl-1-hexyl methacrylate,2-ethylhexyl methacryate,2-propenoic acid, 2-methyl-, 2-ethylhexyl ester,methacrylic acid 2-ethylhexyl ester,methacrylic acid, 2-ethylhexyl ester,methacrylate, 2-ethylisohexy,2-ethylhexylmethacrylate,dsstox_cid_7293,dsstox_rid_78391 PubChem CID: 12713 IUPAC Name: 2-ethylhexyl 2-methylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(=C)C
| PubChem CID | 12713 |
|---|---|
| CAS | 688-84-6 |
| Molecular Weight (g/mol) | 198.31 |
| MDL Number | MFCD00009494 |
| SMILES | CCCCC(CC)COC(=O)C(=C)C |
| Synonym | 2-ethylhexyl methacrylate,2-ethyl-1-hexyl methacrylate,2-ethylhexyl methacryate,2-propenoic acid, 2-methyl-, 2-ethylhexyl ester,methacrylic acid 2-ethylhexyl ester,methacrylic acid, 2-ethylhexyl ester,methacrylate, 2-ethylisohexy,2-ethylhexylmethacrylate,dsstox_cid_7293,dsstox_rid_78391 |
| IUPAC Name | 2-ethylhexyl 2-methylprop-2-enoate |
| InChI Key | WDQMWEYDKDCEHT-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
(2-Methylpropyl)boronic acid, 95+%
CAS: 84110-40-7 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00134156 InChI Key: ZAZPDOYUCVFPOI-UHFFFAOYSA-N Synonym: isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid PubChem CID: 2734395 IUPAC Name: 2-methylpropylboronic acid SMILES: CC(C)CB(O)O
| PubChem CID | 2734395 |
|---|---|
| CAS | 84110-40-7 |
| Molecular Weight (g/mol) | 101.94 |
| MDL Number | MFCD00134156 |
| SMILES | CC(C)CB(O)O |
| Synonym | isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid |
| IUPAC Name | 2-methylpropylboronic acid |
| InChI Key | ZAZPDOYUCVFPOI-UHFFFAOYSA-N |
| Molecular Formula | C4H11BO2 |
Benzyl dimethyl phosphonoacetate, 98%
CAS: 57443-18-2 Molecular Formula: C11H15O5P Molecular Weight (g/mol): 258.21 MDL Number: MFCD01872507 InChI Key: QYLGNJMIOVHLQQ-UHFFFAOYSA-N Synonym: benzyl dimethylphosphonoacetate,benzyl 2-dimethoxyphosphoryl acetate,benzyl dimethyl phosphonoacetate,dimethyl benzyloxycarbonyl methyl phosphonate,acetic acid, dimethoxyphosphinyl-, phenylmethyl ester,acmc-209ly9,benzyl dimethylphosphonoethanoate,dimethyl cbz-methyl phosphonate,benzyl dimethoxyphosphoryl acetate,benzyl-2-dimethoxyphosphoryl acetate PubChem CID: 2773759 IUPAC Name: benzyl 2-dimethoxyphosphorylacetate SMILES: COP(=O)(CC(=O)OCC1=CC=CC=C1)OC
| PubChem CID | 2773759 |
|---|---|
| CAS | 57443-18-2 |
| Molecular Weight (g/mol) | 258.21 |
| MDL Number | MFCD01872507 |
| SMILES | COP(=O)(CC(=O)OCC1=CC=CC=C1)OC |
| Synonym | benzyl dimethylphosphonoacetate,benzyl 2-dimethoxyphosphoryl acetate,benzyl dimethyl phosphonoacetate,dimethyl benzyloxycarbonyl methyl phosphonate,acetic acid, dimethoxyphosphinyl-, phenylmethyl ester,acmc-209ly9,benzyl dimethylphosphonoethanoate,dimethyl cbz-methyl phosphonate,benzyl dimethoxyphosphoryl acetate,benzyl-2-dimethoxyphosphoryl acetate |
| IUPAC Name | benzyl 2-dimethoxyphosphorylacetate |
| InChI Key | QYLGNJMIOVHLQQ-UHFFFAOYSA-N |
| Molecular Formula | C11H15O5P |
Methyl alpha-bromophenylacetate, 97+%
CAS: 3042-81-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00013535 InChI Key: NHFBYYMNJUMVOT-UHFFFAOYSA-N Synonym: methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate PubChem CID: 137806 IUPAC Name: methyl 2-bromo-2-phenylacetate SMILES: COC(=O)C(C1=CC=CC=C1)Br
| PubChem CID | 137806 |
|---|---|
| CAS | 3042-81-7 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00013535 |
| SMILES | COC(=O)C(C1=CC=CC=C1)Br |
| Synonym | methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate |
| IUPAC Name | methyl 2-bromo-2-phenylacetate |
| InChI Key | NHFBYYMNJUMVOT-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4-Hydroxybenzoic acid, sodium salt, 98%
CAS: 114-63-6 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.10 MDL Number: MFCD00016530 InChI Key: ZLVSYODPTJZFMK-UHFFFAOYSA-M Synonym: sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 PubChem CID: 16219477 IUPAC Name: sodium;4-hydroxybenzoate SMILES: [Na+].OC1=CC=C(C=C1)C([O-])=O
| PubChem CID | 16219477 |
|---|---|
| CAS | 114-63-6 |
| Molecular Weight (g/mol) | 160.10 |
| MDL Number | MFCD00016530 |
| SMILES | [Na+].OC1=CC=C(C=C1)C([O-])=O |
| Synonym | sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 |
| IUPAC Name | sodium;4-hydroxybenzoate |
| InChI Key | ZLVSYODPTJZFMK-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO3 |
Calcium Formate, 98%, Pure
CAS: 544-17-2 Molecular Formula: C2H2CaO4 Molecular Weight (g/mol): 130.11 MDL Number: MFCD00036108 InChI Key: CBOCVOKPQGJKKJ-UHFFFAOYSA-L Synonym: calcium formate,calcium diformate,formic acid, calcium salt,calcoform,unii-np3jd65npy,mravencan vapenaty czech,calcium formate ca hco2 2,formic acid calcium salt,np3jd65npy,formic acid, calcium salt 2:1 PubChem CID: 10997 ChEBI: CHEBI:81851 IUPAC Name: calcium;diformate SMILES: C(=O)[O-].C(=O)[O-].[Ca+2]
| PubChem CID | 10997 |
|---|---|
| CAS | 544-17-2 |
| Molecular Weight (g/mol) | 130.11 |
| ChEBI | CHEBI:81851 |
| MDL Number | MFCD00036108 |
| SMILES | C(=O)[O-].C(=O)[O-].[Ca+2] |
| Synonym | calcium formate,calcium diformate,formic acid, calcium salt,calcoform,unii-np3jd65npy,mravencan vapenaty czech,calcium formate ca hco2 2,formic acid calcium salt,np3jd65npy,formic acid, calcium salt 2:1 |
| IUPAC Name | calcium;diformate |
| InChI Key | CBOCVOKPQGJKKJ-UHFFFAOYSA-L |
| Molecular Formula | C2H2CaO4 |
methyl 4-amino-1-methyl-1H-pyrrole-2-carboxylate hydrochloride, Thermo Scientific™
CAS: 180258-45-1 Molecular Formula: C7H11ClN2O2 Molecular Weight (g/mol): 190.63 MDL Number: MFCD01318761 InChI Key: HEOKCJUUKIPIMM-UHFFFAOYSA-N Synonym: methyl 4-amino-1-methyl-1h-pyrrole-2-carboxylate hydrochloride,methyl 4-amino-1-methylpyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate hydrochloride,4-amino-1-methyl-1h-pyrrole-2-carboxylic acid-methyl ester hcl,4-amino-1-methylpyrrole-2-carboxylic acid methyl ester hydrochloride,h-nh 4-mepyl-2-ome hcl,methyl 4-amino-1-methyl-pyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate, hcl,n-methyl-2-carbomethoxy-4-aminopyrrole hydrochloride,3-amino-1-methyl-5-methyloxycarbonylpyrrol hydrochloride PubChem CID: 2794656 SMILES: Cl.COC(=O)C1=CC(N)=CN1C
| PubChem CID | 2794656 |
|---|---|
| CAS | 180258-45-1 |
| Molecular Weight (g/mol) | 190.63 |
| MDL Number | MFCD01318761 |
| SMILES | Cl.COC(=O)C1=CC(N)=CN1C |
| Synonym | methyl 4-amino-1-methyl-1h-pyrrole-2-carboxylate hydrochloride,methyl 4-amino-1-methylpyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate hydrochloride,4-amino-1-methyl-1h-pyrrole-2-carboxylic acid-methyl ester hcl,4-amino-1-methylpyrrole-2-carboxylic acid methyl ester hydrochloride,h-nh 4-mepyl-2-ome hcl,methyl 4-amino-1-methyl-pyrrole-2-carboxylate hydrochloride,methyl-4-amino-1-methyl pyrrole-2-carboxylate, hcl,n-methyl-2-carbomethoxy-4-aminopyrrole hydrochloride,3-amino-1-methyl-5-methyloxycarbonylpyrrol hydrochloride |
| InChI Key | HEOKCJUUKIPIMM-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClN2O2 |
Triethyl 4-phosphonocrotonate, cis + trans, 94%
CAS: 10236-14-3 Molecular Formula: C10H19O5P Molecular Weight (g/mol): 250.23 MDL Number: MFCD00009192 InChI Key: LXLODBXSCRTXFG-BQYQJAHWSA-N Synonym: triethyl 4-phosphonocrotonate,e-ethyl 4-diethoxyphosphoryl but-2-enoate,ethyl 4-diethoxyphosphoryl but-2-enoate,triethyl .gamma.-phosphonocrotonate,ethyl 4-diethylphosphono crotonate,ethyl 2e-4-diethoxyphosphoryl but-2-enoate,ethyl e-4-diethoxyphosphorylbut-2-enoate,ethyl 4-diethylphosphonocrotonate,ethyl trans-4-diethylphosphono crotonate,4-diethoxyphosphinyl crotonic acid ethyl ester PubChem CID: 5365783 IUPAC Name: ethyl (E)-4-diethoxyphosphorylbut-2-enoate SMILES: CCOC(=O)\C=C\CP(=O)(OCC)OCC
| PubChem CID | 5365783 |
|---|---|
| CAS | 10236-14-3 |
| Molecular Weight (g/mol) | 250.23 |
| MDL Number | MFCD00009192 |
| SMILES | CCOC(=O)\C=C\CP(=O)(OCC)OCC |
| Synonym | triethyl 4-phosphonocrotonate,e-ethyl 4-diethoxyphosphoryl but-2-enoate,ethyl 4-diethoxyphosphoryl but-2-enoate,triethyl .gamma.-phosphonocrotonate,ethyl 4-diethylphosphono crotonate,ethyl 2e-4-diethoxyphosphoryl but-2-enoate,ethyl e-4-diethoxyphosphorylbut-2-enoate,ethyl 4-diethylphosphonocrotonate,ethyl trans-4-diethylphosphono crotonate,4-diethoxyphosphinyl crotonic acid ethyl ester |
| IUPAC Name | ethyl (E)-4-diethoxyphosphorylbut-2-enoate |
| InChI Key | LXLODBXSCRTXFG-BQYQJAHWSA-N |
| Molecular Formula | C10H19O5P |
Diisopropyl cyanomethylphosphonate, 97%
CAS: 21658-95-7 Molecular Formula: C8H16NO3P Molecular Weight (g/mol): 205.194 MDL Number: MFCD00009812 InChI Key: MQDIIJHQSUNBKA-UHFFFAOYSA-N Synonym: diisopropyl cyanomethyl phosphonate,diisopropyl cyanomethylphosphonate,diisopropyl cyanomethylphosphonate,,acmc-20al7r,diisopropoxyphosphinylacetonitrile,2-di propan-2-yloxy phosphorylacetonitrile,diisopropyl cyanomethylphosphonate 5g,phosphonic acid,p-cyanomethyl-, bis 1-methylethyl ester PubChem CID: 88997 IUPAC Name: 2-di(propan-2-yloxy)phosphorylacetonitrile SMILES: CC(C)OP(=O)(CC#N)OC(C)C
| PubChem CID | 88997 |
|---|---|
| CAS | 21658-95-7 |
| Molecular Weight (g/mol) | 205.194 |
| MDL Number | MFCD00009812 |
| SMILES | CC(C)OP(=O)(CC#N)OC(C)C |
| Synonym | diisopropyl cyanomethyl phosphonate,diisopropyl cyanomethylphosphonate,diisopropyl cyanomethylphosphonate,,acmc-20al7r,diisopropoxyphosphinylacetonitrile,2-di propan-2-yloxy phosphorylacetonitrile,diisopropyl cyanomethylphosphonate 5g,phosphonic acid,p-cyanomethyl-, bis 1-methylethyl ester |
| IUPAC Name | 2-di(propan-2-yloxy)phosphorylacetonitrile |
| InChI Key | MQDIIJHQSUNBKA-UHFFFAOYSA-N |
| Molecular Formula | C8H16NO3P |
Dimethyl Methylphosphonate, Spectrum™ Chemical
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Triethyl 2-phosphonobutyrate, 97%
CAS: 17145-91-4 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 MDL Number: MFCD00041347 InChI Key: GYUCVQSNZFRDRL-UHFFFAOYSA-N Synonym: triethyl 2-phosphonobutyrate,ethyl 2-diethoxyphosphoryl butanoate,ethyl 2-diethylphosphono butyrate,butanoic acid, 2-diethoxyphosphinyl-, ethyl ester,triethyl 2-phosphonobutanoate,.alpha.-diethylphosphono butanoic acid, ethyl ester,butyric acid, 2-phosphono-, triethyl ester,butyric acid, triethyl ester,triethyl 2-phosphonobu-tyrate,triethyl-2-phosphono butyrate PubChem CID: 229053 IUPAC Name: ethyl 2-diethoxyphosphorylbutanoate SMILES: CCC(C(=O)OCC)P(=O)(OCC)OCC
| PubChem CID | 229053 |
|---|---|
| CAS | 17145-91-4 |
| Molecular Weight (g/mol) | 252.247 |
| MDL Number | MFCD00041347 |
| SMILES | CCC(C(=O)OCC)P(=O)(OCC)OCC |
| Synonym | triethyl 2-phosphonobutyrate,ethyl 2-diethoxyphosphoryl butanoate,ethyl 2-diethylphosphono butyrate,butanoic acid, 2-diethoxyphosphinyl-, ethyl ester,triethyl 2-phosphonobutanoate,.alpha.-diethylphosphono butanoic acid, ethyl ester,butyric acid, 2-phosphono-, triethyl ester,butyric acid, triethyl ester,triethyl 2-phosphonobu-tyrate,triethyl-2-phosphono butyrate |
| IUPAC Name | ethyl 2-diethoxyphosphorylbutanoate |
| InChI Key | GYUCVQSNZFRDRL-UHFFFAOYSA-N |
| Molecular Formula | C10H21O5P |
3-Butynyl p-toluenesulfonate, 96%
CAS: 23418-85-1 Molecular Formula: C11H12O3S Molecular Weight (g/mol): 224.28 MDL Number: MFCD00041687 InChI Key: STOASOOVVADOKH-UHFFFAOYSA-N Synonym: 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq PubChem CID: 272020 IUPAC Name: but-3-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC#C
| PubChem CID | 272020 |
|---|---|
| CAS | 23418-85-1 |
| Molecular Weight (g/mol) | 224.28 |
| MDL Number | MFCD00041687 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCC#C |
| Synonym | 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq |
| IUPAC Name | but-3-ynyl 4-methylbenzenesulfonate |
| InChI Key | STOASOOVVADOKH-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3S |
Biphenyl-4,4'-diboronic acid, 94%
CAS: 4151-80-8 Molecular Formula: C12H12B2O4 Molecular Weight (g/mol): 241.84 MDL Number: MFCD00151795 InChI Key: SLHKDOGTVUCXKX-UHFFFAOYSA-N Synonym: 4,4'-biphenyldiboronic acid,1,1'-biphenyl-4,4'-diyldiboronic acid,biphenyl-4,4'-diboronic acid,4-4-boronophenyl phenyl boronic acid,biphenyl-4,4'-diyldiboronic acid,pubchem5324,acmc-1apw8,4,4'-biphenyldiboric acid,4,4-biphenyldiboronic acid,4,4'-diboronobiphenyl PubChem CID: 2734608 IUPAC Name: [4-(4-boronophenyl)phenyl]boronic acid SMILES: OB(O)C1=CC=C(C=C1)C1=CC=C(C=C1)B(O)O
| PubChem CID | 2734608 |
|---|---|
| CAS | 4151-80-8 |
| Molecular Weight (g/mol) | 241.84 |
| MDL Number | MFCD00151795 |
| SMILES | OB(O)C1=CC=C(C=C1)C1=CC=C(C=C1)B(O)O |
| Synonym | 4,4'-biphenyldiboronic acid,1,1'-biphenyl-4,4'-diyldiboronic acid,biphenyl-4,4'-diboronic acid,4-4-boronophenyl phenyl boronic acid,biphenyl-4,4'-diyldiboronic acid,pubchem5324,acmc-1apw8,4,4'-biphenyldiboric acid,4,4-biphenyldiboronic acid,4,4'-diboronobiphenyl |
| IUPAC Name | [4-(4-boronophenyl)phenyl]boronic acid |
| InChI Key | SLHKDOGTVUCXKX-UHFFFAOYSA-N |
| Molecular Formula | C12H12B2O4 |
Diphenylamine-4-sulfonic acid, sodium salt, ACS reagent
CAS: 6152-67-6 Molecular Formula: C12H11NNaO3S Molecular Weight (g/mol): 272.27 MDL Number: MFCD00036468 InChI Key: VMVSDVIYIMNZBS-UHFFFAOYSA-N Synonym: sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt PubChem CID: 517002 IUPAC Name: sodium;4-anilinobenzenesulfonate SMILES: [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1
| PubChem CID | 517002 |
|---|---|
| CAS | 6152-67-6 |
| Molecular Weight (g/mol) | 272.27 |
| MDL Number | MFCD00036468 |
| SMILES | [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1 |
| Synonym | sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt |
| IUPAC Name | sodium;4-anilinobenzenesulfonate |
| InChI Key | VMVSDVIYIMNZBS-UHFFFAOYSA-N |
| Molecular Formula | C12H11NNaO3S |
1-Acetyl-1H-pyrazole-4-boronic acid pinacol ester, 97%, Thermo Scientific Chemicals
CAS: 1150561-76-4 Molecular Formula: C11H17BN2O3 Molecular Weight (g/mol): 236.08 MDL Number: MFCD09027064 InChI Key: GAXOQGDPSCOOLC-UHFFFAOYSA-N Synonym: 1-acetyl-1h-pyrazole-4-boronic acid, pinacol ester,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl-ethanone,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl ethanone,1-acetylpyrazole-4-boronic acid pinacol ester,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazol-1-yl ethanone,1-4-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazol-1-yl ethanone,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl ethan-1-one,ethanone,1-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-pyrazol-1-yl PubChem CID: 17750204 IUPAC Name: 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethanone SMILES: CC(=O)N1C=C(C=N1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 17750204 |
|---|---|
| CAS | 1150561-76-4 |
| Molecular Weight (g/mol) | 236.08 |
| MDL Number | MFCD09027064 |
| SMILES | CC(=O)N1C=C(C=N1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 1-acetyl-1h-pyrazole-4-boronic acid, pinacol ester,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl-ethanone,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl ethanone,1-acetylpyrazole-4-boronic acid pinacol ester,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazol-1-yl ethanone,1-4-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazol-1-yl ethanone,1-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazol-1-yl ethan-1-one,ethanone,1-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-pyrazol-1-yl |
| IUPAC Name | 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethanone |
| InChI Key | GAXOQGDPSCOOLC-UHFFFAOYSA-N |
| Molecular Formula | C11H17BN2O3 |