Organic acids and derivatives
5-Bromoindoxyl diacetate, 98+%, Thermo Scientific Chemicals
CAS: 33588-54-4 Molecular Formula: C12H10BrNO3 Molecular Weight (g/mol): 296.12 MDL Number: MFCD00005799 InChI Key: XJRIDJAGAYGJCK-UHFFFAOYSA-N Synonym: 5-bromoindoxyl diacetate,1-acetyl-5-bromo-1h-indol-3-yl acetate,5-bromoindoxyldiacetate,n-acetyl-5-bromoindolyl acetate,1-acetyl-3-acetyloxy-5-bromoindole,3-acetoxy-1-acetyl-5-bromoindole,1h-indol-3-ol, 1-acetyl-5-bromo-, acetate ester,3-acetoxy-1-acetyl-5-bromo-indole,1h-indol-3-ol, 1-acetyl-5-bromo-, acetate,pubchem16263 PubChem CID: 118505 IUPAC Name: (1-acetyl-5-bromoindol-3-yl) acetate SMILES: CC(=O)N1C=C(C2=C1C=CC(=C2)Br)OC(=O)C
Triethyl 4-phosphonobutyrate, 97%
CAS: 2327-69-7 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 MDL Number: MFCD00015168 InChI Key: FYESTJSRASJZOY-UHFFFAOYSA-N PubChem CID: 281201 IUPAC Name: ethyl 4-diethoxyphosphorylbutanoate SMILES: CCOC(=O)CCCP(=O)(OCC)OCC
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
Benzyl 5-amino-1H-pyrazole-4-carboxylate, 98+%
CAS: 32016-28-7 Molecular Formula: C11H11N3O2 Molecular Weight (g/mol): 217.23 MDL Number: MFCD03426023 InChI Key: QBEUXDWEKIOSIL-UHFFFAOYSA-N Synonym: benzyl 5-aminopyrazole-4-carboxylate,benzyl 3-amino-2h-pyrazole-4-carboxylate,acmc-20alpl,phenylmethyl 5-aminopyrazole-4-carboxylate,3-amino-1h-pyrazole-4-carboxylic acid benzyl ester,1h-pyrazole-4-carboxylicacid, 3-amino-, phenylmethyl ester PubChem CID: 4360500 IUPAC Name: benzyl 5-amino-1H-pyrazole-4-carboxylate SMILES: NC1=C(C=NN1)C(=O)OCC1=CC=CC=C1
2-Benzyloxybenzeneboronic acid, 96%
CAS: 190661-29-1 Molecular Formula: C13H13BO3 Molecular Weight (g/mol): 228.054 MDL Number: MFCD01632206 InChI Key: MCAIDINWZOCYQK-UHFFFAOYSA-N Synonym: 2-benzyloxyphenylboronic acid,2-benzyloxy phenylboronic acid,2-benzyloxybenzeneboronic acid,2-benzyloxy phenyl boronic acid,2-benzyloxyphenyl boronic acid,2-benzyloxyphenylborornic acid,2-benzyloxy phenyl boranediol,o-benzyloxyphenylboronic acid,boronic acid, 2-phenylmethoxy phenyl PubChem CID: 2773253 IUPAC Name: (2-phenylmethoxyphenyl)boronic acid SMILES: B(C1=CC=CC=C1OCC2=CC=CC=C2)(O)O
2-Fluoro-3-methoxybenzeneboronic acid, 97%, Thermo Scientific Chemicals
CAS: 352303-67-4 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.946 MDL Number: MFCD02094728 InChI Key: JCKZNMSBFBPDPM-UHFFFAOYSA-N Synonym: 2-fluoro-3-methoxyphenyl boronic acid,2-fluoro-3-methoxybenzeneboronic acid,2-fluoro-3-methoxyphenyl boranediol,2-fluoro-3-methoxyphenylboronicacid,boronic acid, 2-fluoro-3-methoxyphenyl,pubchem1848,2-fluoro-3-methoxy-phenyl boronic acid,acmc-1af04,2-fluoro-3-methoxy-phenylboronic acid PubChem CID: 4985744 IUPAC Name: (2-fluoro-3-methoxyphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)OC)F)(O)O
Cyclohexyl p-toluenesulfonate, 97%
CAS: 953-91-3 Molecular Formula: C13H18O3S Molecular Weight (g/mol): 254.344 MDL Number: MFCD00014291 InChI Key: OHHPZPDQZMUTCA-UHFFFAOYSA-N Synonym: cyclohexyl p-toluenesulfonate,cyclohexyl tosylate,cyclohexyl toluenesulfonate,cyclohexylp-toluenesulfonate,cyclohexyl p-toluenesulphonate,benzenesulfonic acid, 4-methyl-, cyclohexyl ester,p-toluenesulfonic acid, cyclohexyl ester,cyclohexyl-p-toluene sulfonate,benzenesulfonic acid, cyclohexyl ester,acmc-20aj06 PubChem CID: 13722 IUPAC Name: cyclohexyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2
3,4,5-Trimethoxybenzeneboronic acid, 98%
CAS: 182163-96-8 Molecular Formula: C9H13BO5 Molecular Weight (g/mol): 212.008 MDL Number: MFCD01075676 InChI Key: RULQUTYJXDLRFL-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxybenzeneboronic acid,3,4,5-trimethoxyphenyl boronic acid,3,4,5-trimethoxyphenyl boranediol,3,4,5-trimethoxylphenylboronic acid,boronic acid, 3,4,5-trimethoxyphenyl,pubchem7894,acmc-1c5iu,ksc174i9j,3,4,5-trimethoxy phenylboronic acid PubChem CID: 2734390 IUPAC Name: (3,4,5-trimethoxyphenyl)boronic acid SMILES: B(C1=CC(=C(C(=C1)OC)OC)OC)(O)O
Ethyl benzimidate hydrochloride, 97%
CAS: 5333-86-8 Molecular Formula: C9H12ClNO Molecular Weight (g/mol): 185.65 MDL Number: MFCD00043246 InChI Key: MODZVIMSNXSQIH-UHFFFAOYSA-N Synonym: ethyl benzimidate hydrochloride,benzenecarboximidic acid, ethyl ester, hydrochloride,ethyl benzenecarboximidate hydrochloride,benzimidic acid ethyl ester hcl,ethylbenzimidate hydrochloride,ethyl benzimidate hcl,ethyl benzylimidate hydrochloride,ethyl iminobenzoate hydrochloride,benzimido ethyl ether hydrochloride,benzimidoyl ethyl ether hydrochloride PubChem CID: 79249 IUPAC Name: ethyl benzenecarboximidate;hydrochloride SMILES: [H+].[Cl-].CCOC(=N)C1=CC=CC=C1
Ethyl (R)-(+)-4-chloro-3-hydroxybutyrate, 97%, ee 96%
CAS: 90866-33-4 Molecular Formula: C6H11ClO3 Molecular Weight (g/mol): 166.601 MDL Number: MFCD00211242 InChI Key: ZAJNMXDBJKCCAT-RXMQYKEDSA-N Synonym: ethyl r-+-4-chloro-3-hydroxybutyrate,r-ethyl 4-chloro-3-hydroxybutanoate,ethyl 3r-4-chloro-3-hydroxybutanoate,ethyl r-4-chloro-3-hydroxybutyrate,ethyl r-+-4-chloro-3-hydroxybutanoate,r-4-chloro-3-hydroxybutyric acid ethyl ester,s-4-chloro-3-hydroxy-butyric acid ethyl ester,r-4-chloro-3-hydroxy-n-butyric acid ethyl ester,ethyl r-4-chloro-3-hydroxybutanoate,butanoic acid, 4-chloro-3-hydroxy-, ethyl ester, 3r PubChem CID: 2734445 IUPAC Name: ethyl (3R)-4-chloro-3-hydroxybutanoate SMILES: CCOC(=O)CC(CCl)O
Diisopropyl bromomethylphosphonate, 97%
CAS: 98432-80-5 Molecular Formula: C7H16BrO3P Molecular Weight (g/mol): 259.08 MDL Number: MFCD00236036 InChI Key: JNONGIUWXHOEEN-UHFFFAOYSA-N Synonym: diisopropyl bromomethylphosphonate,bromomethylphosphonic acid diisopropyl ester,diisopropyl bromomethyl phosphonate,bromomethylphosphonate diisopropyl ester,2-bromomethyl propan-2-yloxy phosphoryl oxypropane PubChem CID: 4366885 IUPAC Name: 2-[bromomethyl(propan-2-yloxy)phosphoryl]oxypropane SMILES: CC(C)OP(=O)(CBr)OC(C)C
3-Hydroxy-2,2-dimethylpropionic acid, 97+%
CAS: 4835-90-9 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00059953 InChI Key: RDFQSFOGKVZWKF-UHFFFAOYSA-N Synonym: hydroxypivalic acid,3-hydroxypivalic acid,2,2-dimethyl-3-hydroxypropionic acid,propanoic acid, 3-hydroxy-2,2-dimethyl,3-hydroxy-2,2-dimethylpropionic acid,unii-bjp2cxk56p,bjp2cxk56p,acmc-1arbc,beta-hydroxy pivalic acid PubChem CID: 78548 IUPAC Name: 3-hydroxy-2,2-dimethylpropanoic acid SMILES: CC(C)(CO)C(=O)O
2(5H)-Furanone, 96%
CAS: 497-23-4 Molecular Formula: C4H4O2 Molecular Weight (g/mol): 84.07 MDL Number: MFCD00005376 InChI Key: VIHAEDVKXSOUAT-UHFFFAOYSA-N Synonym: 2 5h-furanone,furan-2 5h-one,butenolide,2-butenolide,gamma-crotonolactone,2-buten-4-olide,isocrotonolactone,2-oxo-2,5-dihydrofuran,crotonolactone,2-5h-furanone PubChem CID: 10341 ChEBI: CHEBI:38118 IUPAC Name: 2H-furan-5-one SMILES: O=C1OCC=C1
4-n-Nonylbenzeneboronic acid, 98+%
CAS: 256383-45-6 Molecular Formula: C15H25BO2 Molecular Weight (g/mol): 248.173 MDL Number: MFCD02093070 InChI Key: VONVJOGSLHAKOX-UHFFFAOYSA-N Synonym: 4-n-nonylphenylboronic acid,4-n-nonylbenzeneboronic acid,4-nonylphenyl boronic acid,4-n-nonylphenylboronicacid,4-nonylphenyl boranediol,d0f1ud,4-nonylbenzene boronic acid,b-4-nonylphenyl boronic acid,4-n-nonyl benzeneboronic acid,1-borono-4-non-1-yl benzene PubChem CID: 4589192 IUPAC Name: (4-nonylphenyl)boronic acid SMILES: B(C1=CC=C(C=C1)CCCCCCCCC)(O)O
1-Octylphosphonic acid, 99%
CAS: 4724-48-5 Molecular Formula: C8H19O3P Molecular Weight (g/mol): 194.211 MDL Number: MFCD00015841 InChI Key: NJGCRMAPOWGWMW-UHFFFAOYSA-N Synonym: n-octylphosphonic acid,1-octylphosphonic acid,phosphonic acid, octyl,phosphonic acid, p-octyl,unii-95c2aw87bo,octylphosphonicacid,acmc-209uni,p-octyl-phosphonic acid,octylphosphonic acid,dsstox_cid_24679 PubChem CID: 78452 IUPAC Name: octylphosphonic acid SMILES: CCCCCCCCP(=O)(O)O