Organic acids and derivatives
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Chloroacetic Acid, Crystal, ACS, 99%, Spectrum™ Chemical
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CAS: 79-11-8 Molecular Formula: C2H3ClO2 Molecular Weight (g/mol): 94.49 InChI Key: FOCAUTSVDIKZOP-UHFFFAOYSA-N IUPAC Name: 2-chloroacetic acid SMILES: OC(=O)CCl
| CAS | 79-11-8 |
|---|---|
| Molecular Weight (g/mol) | 94.49 |
| SMILES | OC(=O)CCl |
| IUPAC Name | 2-chloroacetic acid |
| InChI Key | FOCAUTSVDIKZOP-UHFFFAOYSA-N |
| Molecular Formula | C2H3ClO2 |
Ethyl alpha-bromophenylacetate, 97%
CAS: 2882-19-1 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.10 MDL Number: MFCD00013536 InChI Key: BKTKLDMYHTUESO-UHFFFAOYNA-N Synonym: ethyl alpha-bromophenylacetate,ethyl bromophenylacetate,ethyl bromo phenyl acetate,ethyl-alpha-bromophenyl acetate,ethyl-.alpha.-bromophenyl acetate,benzeneacetic acid, .alpha.-bromo-, ethyl ester,bromo-phenyl-acetic acid ethyl ester,benzeneacetic acid, alpha-bromo-, ethyl ester,eyr&vo2,ethylbromo phenyl acetate PubChem CID: 97780 IUPAC Name: ethyl 2-bromo-2-phenylacetate SMILES: CCOC(=O)C(Br)C1=CC=CC=C1
| PubChem CID | 97780 |
|---|---|
| CAS | 2882-19-1 |
| Molecular Weight (g/mol) | 243.10 |
| MDL Number | MFCD00013536 |
| SMILES | CCOC(=O)C(Br)C1=CC=CC=C1 |
| Synonym | ethyl alpha-bromophenylacetate,ethyl bromophenylacetate,ethyl bromo phenyl acetate,ethyl-alpha-bromophenyl acetate,ethyl-.alpha.-bromophenyl acetate,benzeneacetic acid, .alpha.-bromo-, ethyl ester,bromo-phenyl-acetic acid ethyl ester,benzeneacetic acid, alpha-bromo-, ethyl ester,eyr&vo2,ethylbromo phenyl acetate |
| IUPAC Name | ethyl 2-bromo-2-phenylacetate |
| InChI Key | BKTKLDMYHTUESO-UHFFFAOYNA-N |
| Molecular Formula | C10H11BrO2 |
Bromoacetic acid, 98+%
CAS: 79-08-3 Molecular Formula: C2H3BrO2 Molecular Weight (g/mol): 138.95 MDL Number: MFCD00002678 InChI Key: KDPAWGWELVVRCH-UHFFFAOYSA-N Synonym: bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo PubChem CID: 6227 IUPAC Name: 2-bromoacetic acid SMILES: C(C(=O)O)Br
| PubChem CID | 6227 |
|---|---|
| CAS | 79-08-3 |
| Molecular Weight (g/mol) | 138.95 |
| MDL Number | MFCD00002678 |
| SMILES | C(C(=O)O)Br |
| Synonym | bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo |
| IUPAC Name | 2-bromoacetic acid |
| InChI Key | KDPAWGWELVVRCH-UHFFFAOYSA-N |
| Molecular Formula | C2H3BrO2 |
Isopropyl 2-bromo-2-methylpropanoate, 97%, Thermo Scientific™
CAS: 51368-55-9 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 MDL Number: MFCD00055235 InChI Key: UNZJYKKJZGIFCG-UHFFFAOYSA-N Synonym: isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester PubChem CID: 2796293 IUPAC Name: propan-2-yl 2-bromo-2-methylpropanoate SMILES: CC(C)OC(=O)C(C)(C)Br
| PubChem CID | 2796293 |
|---|---|
| CAS | 51368-55-9 |
| Molecular Weight (g/mol) | 209.08 |
| MDL Number | MFCD00055235 |
| SMILES | CC(C)OC(=O)C(C)(C)Br |
| Synonym | isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester |
| IUPAC Name | propan-2-yl 2-bromo-2-methylpropanoate |
| InChI Key | UNZJYKKJZGIFCG-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Ethyl chloroacetate, 99%
CAS: 105-39-5 MDL Number: MFCD00000932 InChI Key: VEUUMBGHMNQHGO-UHFFFAOYSA-N Synonym: ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf PubChem CID: 7751 IUPAC Name: ethyl 2-chloroacetate SMILES: CCOC(=O)CCl
| PubChem CID | 7751 |
|---|---|
| CAS | 105-39-5 |
| MDL Number | MFCD00000932 |
| SMILES | CCOC(=O)CCl |
| Synonym | ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf |
| IUPAC Name | ethyl 2-chloroacetate |
| InChI Key | VEUUMBGHMNQHGO-UHFFFAOYSA-N |
3H-Tetrafluoropropionic acid, 97%
CAS: 756-09-2 Molecular Formula: C3H2F4O2 Molecular Weight (g/mol): 146.041 MDL Number: MFCD00054686 InChI Key: PXRROZVNOOEPPZ-UHFFFAOYSA-N Synonym: flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa PubChem CID: 69789 ChEBI: CHEBI:82013 IUPAC Name: 2,2,3,3-tetrafluoropropanoic acid SMILES: C(C(C(=O)O)(F)F)(F)F
| PubChem CID | 69789 |
|---|---|
| CAS | 756-09-2 |
| Molecular Weight (g/mol) | 146.041 |
| ChEBI | CHEBI:82013 |
| MDL Number | MFCD00054686 |
| SMILES | C(C(C(=O)O)(F)F)(F)F |
| Synonym | flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa |
| IUPAC Name | 2,2,3,3-tetrafluoropropanoic acid |
| InChI Key | PXRROZVNOOEPPZ-UHFFFAOYSA-N |
| Molecular Formula | C3H2F4O2 |
1,3-Diazaspiro[4.5]decane-2,4-dione, 97%, Thermo Scientific™
CAS: 702-62-5 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.196 MDL Number: MFCD00022404 InChI Key: NERNEXMEYQFFHU-UHFFFAOYSA-N Synonym: 1,3-diazaspiro 4.5 decane-2,4-dione,5,5-pentamethylenehydantoin,hydantoin, pentamethylene,5,5'-cyclohexanespirohydantoin,5,5-pentamethylenespirohydantoin,hydantoin, 5,5-pentamethylene,cyclohexanespiro-5'-hydantoin,spiro cyclohexane-1,5'-hydantoin,2,4-diazaspiro 4.5 decane-1,3-dione,cyclohexane-spiro-5-hydantoin PubChem CID: 12799 IUPAC Name: 1,3-diazaspiro[4.5]decane-2,4-dione SMILES: C1CCC2(CC1)C(=O)NC(=O)N2
| PubChem CID | 12799 |
|---|---|
| CAS | 702-62-5 |
| Molecular Weight (g/mol) | 168.196 |
| MDL Number | MFCD00022404 |
| SMILES | C1CCC2(CC1)C(=O)NC(=O)N2 |
| Synonym | 1,3-diazaspiro 4.5 decane-2,4-dione,5,5-pentamethylenehydantoin,hydantoin, pentamethylene,5,5'-cyclohexanespirohydantoin,5,5-pentamethylenespirohydantoin,hydantoin, 5,5-pentamethylene,cyclohexanespiro-5'-hydantoin,spiro cyclohexane-1,5'-hydantoin,2,4-diazaspiro 4.5 decane-1,3-dione,cyclohexane-spiro-5-hydantoin |
| IUPAC Name | 1,3-diazaspiro[4.5]decane-2,4-dione |
| InChI Key | NERNEXMEYQFFHU-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2O2 |
4-Amino-3-hydroxy-1-naphthalene Sulfonic Acid, ACS, 90%, Spectrum™ Chemical
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CAS: 116-63-2 Molecular Formula: C10H9NO4S Molecular Weight (g/mol): 239.25 InChI Key: RXCMFQDTWCCLBL-UHFFFAOYSA-N IUPAC Name: 4-amino-3-hydroxynaphthalene-1-sulfonic acid SMILES: NC1=C2C=CC=CC2=C(C=C1O)S(O)(=O)=O
| CAS | 116-63-2 |
|---|---|
| Molecular Weight (g/mol) | 239.25 |
| SMILES | NC1=C2C=CC=CC2=C(C=C1O)S(O)(=O)=O |
| IUPAC Name | 4-amino-3-hydroxynaphthalene-1-sulfonic acid |
| InChI Key | RXCMFQDTWCCLBL-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO4S |
2,3-Dihydro-1-benzofuran-5-ylboronic acid, 95%, May contain varying amounts of anhydride, Thermo Scientific™
CAS: 227305-69-3 Molecular Formula: C8H9BO3 Molecular Weight (g/mol): 163.97 MDL Number: MFCD02681979 InChI Key: ZIXLJHSFAMVHPC-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzofuran-5-boronic acid,2,3-dihydrobenzofuran-5-ylboronic acid,2,3-dihydrobenzofuran-5-yl boronic acid,2,3-dihydrobenzo b furan-5-boronic acid,2,3-dihydrobenzofuran-5-yl-5-boronic acid,boronic acid, 2,3-dihydro-5-benzofuranyl,2,3-dihydro-1-benzofuran-5-yl-boranediol,2,3-dihydro-1-benzofuran-5-yl boronic acid,pubchem7848,zlchem 1108 PubChem CID: 2773380 SMILES: OB(O)C1=CC=C2OCCC2=C1
| PubChem CID | 2773380 |
|---|---|
| CAS | 227305-69-3 |
| Molecular Weight (g/mol) | 163.97 |
| MDL Number | MFCD02681979 |
| SMILES | OB(O)C1=CC=C2OCCC2=C1 |
| Synonym | 2,3-dihydrobenzofuran-5-boronic acid,2,3-dihydrobenzofuran-5-ylboronic acid,2,3-dihydrobenzofuran-5-yl boronic acid,2,3-dihydrobenzo b furan-5-boronic acid,2,3-dihydrobenzofuran-5-yl-5-boronic acid,boronic acid, 2,3-dihydro-5-benzofuranyl,2,3-dihydro-1-benzofuran-5-yl-boranediol,2,3-dihydro-1-benzofuran-5-yl boronic acid,pubchem7848,zlchem 1108 |
| InChI Key | ZIXLJHSFAMVHPC-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO3 |
5-(Methylsulfonyl)pyridine-3-boronic acid, 98%
CAS: 913836-01-8 Molecular Formula: C6H8BNO4S Molecular Weight (g/mol): 201.00 MDL Number: MFCD08689536 InChI Key: YGXNPQDXWDCWET-UHFFFAOYSA-N Synonym: 5-methylsulphonyl pyridine-3-boronic acid,5-methylsulfonyl pyridine-3-boronic acid,5-methylsulfonyl pyridin-3-yl boronic acid,5-methylsulfonyl-3-pyridineboronic acid,boronicacid, b-5-methylsulfonyl-3-pyridinyl,5-methanesulfonylpyridin-3-ylboronic acid,b-5-methylsulfonyl-3-pyridinyl boronic acid,acmc-209ram PubChem CID: 44119381 IUPAC Name: (5-methanesulfonylpyridin-3-yl)boronic acid SMILES: CS(=O)(=O)C1=CN=CC(=C1)B(O)O
| PubChem CID | 44119381 |
|---|---|
| CAS | 913836-01-8 |
| Molecular Weight (g/mol) | 201.00 |
| MDL Number | MFCD08689536 |
| SMILES | CS(=O)(=O)C1=CN=CC(=C1)B(O)O |
| Synonym | 5-methylsulphonyl pyridine-3-boronic acid,5-methylsulfonyl pyridine-3-boronic acid,5-methylsulfonyl pyridin-3-yl boronic acid,5-methylsulfonyl-3-pyridineboronic acid,boronicacid, b-5-methylsulfonyl-3-pyridinyl,5-methanesulfonylpyridin-3-ylboronic acid,b-5-methylsulfonyl-3-pyridinyl boronic acid,acmc-209ram |
| IUPAC Name | (5-methanesulfonylpyridin-3-yl)boronic acid |
| InChI Key | YGXNPQDXWDCWET-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNO4S |
Dibenzo[b,d]thiophen-2-ylboronic acid, 97%, Thermo Scientific™
CAS: 668983-97-9 Molecular Formula: C12H9BO2S Molecular Weight (g/mol): 228.072 MDL Number: MFCD01318982 InChI Key: CSLSCVHILGCSTE-UHFFFAOYSA-N Synonym: dibenzo b,d thiophen-2-ylboronic acid,dibenzothiophene-2-boronic acid,dibenzo b,d thien-2-ylboronic acid,dibenzothiophen-2-yl-dihydroxy-borane,boronic acid, 2-dibenzothienyl,boronic acid, b-2-dibenzothienyl,dibenzo b,d thiophen-2-ylboronic acid contains varying amounts of anhydride,dibenzo b,d thien-2-ylboronic acid saltdata: free,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaen-4-ylboronic acid,ksc352o5l PubChem CID: 2794660 IUPAC Name: dibenzothiophen-2-ylboronic acid SMILES: B(C1=CC2=C(C=C1)SC3=CC=CC=C32)(O)O
| PubChem CID | 2794660 |
|---|---|
| CAS | 668983-97-9 |
| Molecular Weight (g/mol) | 228.072 |
| MDL Number | MFCD01318982 |
| SMILES | B(C1=CC2=C(C=C1)SC3=CC=CC=C32)(O)O |
| Synonym | dibenzo b,d thiophen-2-ylboronic acid,dibenzothiophene-2-boronic acid,dibenzo b,d thien-2-ylboronic acid,dibenzothiophen-2-yl-dihydroxy-borane,boronic acid, 2-dibenzothienyl,boronic acid, b-2-dibenzothienyl,dibenzo b,d thiophen-2-ylboronic acid contains varying amounts of anhydride,dibenzo b,d thien-2-ylboronic acid saltdata: free,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaen-4-ylboronic acid,ksc352o5l |
| IUPAC Name | dibenzothiophen-2-ylboronic acid |
| InChI Key | CSLSCVHILGCSTE-UHFFFAOYSA-N |
| Molecular Formula | C12H9BO2S |
3-Carboxy-4-methoxybenzeneboronic acid, 98%, Thermo Scientific Chemicals
CAS: 913836-12-1 Molecular Formula: C8H9BO5 Molecular Weight (g/mol): 195.965 MDL Number: MFCD06203322 InChI Key: YZKWFWNYFKBAHO-UHFFFAOYSA-N Synonym: 3-carboxy-4-methoxyphenylboronic acid,5-dihydroxyboranyl-2-methoxybenzoic acid,benzoicacid, 5-borono-2-methoxy-9ci,3-carboxy-4-methoxybenzeneboronic acid,benzoic acid, 5-borono-2-methoxy,acmc-209raw,ksc486i0n,5-dihydroxyboryl-2-methoxybenzoic acid PubChem CID: 44119154 IUPAC Name: 5-borono-2-methoxybenzoic acid SMILES: B(C1=CC(=C(C=C1)OC)C(=O)O)(O)O
| PubChem CID | 44119154 |
|---|---|
| CAS | 913836-12-1 |
| Molecular Weight (g/mol) | 195.965 |
| MDL Number | MFCD06203322 |
| SMILES | B(C1=CC(=C(C=C1)OC)C(=O)O)(O)O |
| Synonym | 3-carboxy-4-methoxyphenylboronic acid,5-dihydroxyboranyl-2-methoxybenzoic acid,benzoicacid, 5-borono-2-methoxy-9ci,3-carboxy-4-methoxybenzeneboronic acid,benzoic acid, 5-borono-2-methoxy,acmc-209raw,ksc486i0n,5-dihydroxyboryl-2-methoxybenzoic acid |
| IUPAC Name | 5-borono-2-methoxybenzoic acid |
| InChI Key | YZKWFWNYFKBAHO-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO5 |
5-Cyano-2-hydroxybenzeneboronic acid, 96%
CAS: 1256355-57-3 Molecular Formula: C7H6BNO3 Molecular Weight (g/mol): 162.939 InChI Key: QXWBHAJKEPWEBD-UHFFFAOYSA-N Synonym: 5-cyano-2-hydroxyphenyl boronic acid,acmc-209az5,boronic acid, b-5-cyano-2-hydroxyphenyl PubChem CID: 53216735 IUPAC Name: (5-cyano-2-hydroxyphenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)C#N)O)(O)O
| PubChem CID | 53216735 |
|---|---|
| CAS | 1256355-57-3 |
| Molecular Weight (g/mol) | 162.939 |
| SMILES | B(C1=C(C=CC(=C1)C#N)O)(O)O |
| Synonym | 5-cyano-2-hydroxyphenyl boronic acid,acmc-209az5,boronic acid, b-5-cyano-2-hydroxyphenyl |
| IUPAC Name | (5-cyano-2-hydroxyphenyl)boronic acid |
| InChI Key | QXWBHAJKEPWEBD-UHFFFAOYSA-N |
| Molecular Formula | C7H6BNO3 |
1-Butanesulfonic Acid, Sodium Salt, BAKER™, J.T. Baker™
CAS: 2386-54-1 Molecular Formula: C4H9NaO3S Molecular Weight (g/mol): 160.16 MDL Number: MFCD00007540 InChI Key: XQCHMGAOAWZUPI-UHFFFAOYSA-M Synonym: sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot PubChem CID: 4096517 IUPAC Name: sodium butane-1-sulfonate SMILES: [Na+].CCCCS([O-])(=O)=O
| PubChem CID | 4096517 |
|---|---|
| CAS | 2386-54-1 |
| Molecular Weight (g/mol) | 160.16 |
| MDL Number | MFCD00007540 |
| SMILES | [Na+].CCCCS([O-])(=O)=O |
| Synonym | sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot |
| IUPAC Name | sodium butane-1-sulfonate |
| InChI Key | XQCHMGAOAWZUPI-UHFFFAOYSA-M |
| Molecular Formula | C4H9NaO3S |
N,N-Diethyl-p-Phenylenediamine Sulfate, Spectrum™ Chemical
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CAS: 6283-63-2
| CAS | 6283-63-2 |
|---|