Organic acids and derivatives
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4-Acetyl-2-Fluorobiphenyl, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™
This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.
Egestrol, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™
This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets have been developed and issued under the Authority of the issuing Pharmacopoeia.
N1-(1-Oxo-2,3-dihydro-1H-inden-5-yl)acetamide, 97%, Thermo Scientific™
CAS: 58161-35-6 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD00099465 InChI Key: GHUPGGYDRVSZSW-UHFFFAOYSA-N Synonym: n-1-oxo-2,3-dihydro-1h-inden-5-yl acetamide,n1-1-oxo-2,3-dihydro-1h-inden-5-yl acetamide,5-acetamido-1-indanone,5-acetylamino-1-indanone,n-1-oxoindan-5-yl acetamide,n-1-oxo-2,3-dihydroinden-5-yl acetamide,acetamide, n-2,3-dihydro-1-oxo-1h-inden-5-yl,5-acetamido-2,3-dihydro-1-oxo-1h-indene,5-acetamido-indanone PubChem CID: 312894 IUPAC Name: N-(1-oxo-2,3-dihydroinden-5-yl)acetamide SMILES: CC(=O)NC1=CC2=C(C=C1)C(=O)CC2
| PubChem CID | 312894 |
|---|---|
| CAS | 58161-35-6 |
| Molecular Weight (g/mol) | 189.214 |
| MDL Number | MFCD00099465 |
| SMILES | CC(=O)NC1=CC2=C(C=C1)C(=O)CC2 |
| Synonym | n-1-oxo-2,3-dihydro-1h-inden-5-yl acetamide,n1-1-oxo-2,3-dihydro-1h-inden-5-yl acetamide,5-acetamido-1-indanone,5-acetylamino-1-indanone,n-1-oxoindan-5-yl acetamide,n-1-oxo-2,3-dihydroinden-5-yl acetamide,acetamide, n-2,3-dihydro-1-oxo-1h-inden-5-yl,5-acetamido-2,3-dihydro-1-oxo-1h-indene,5-acetamido-indanone |
| IUPAC Name | N-(1-oxo-2,3-dihydroinden-5-yl)acetamide |
| InChI Key | GHUPGGYDRVSZSW-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
3-Methylbutanamide, 97%, Thermo Scientific™
CAS: 541-46-8 Molecular Formula: C5H11NO Molecular Weight (g/mol): 101.149 MDL Number: MFCD00014807 InChI Key: SANOUVWGPVYVAV-UHFFFAOYSA-N Synonym: isovaleramide,butanamide, 3-methyl,3-methylbutyramide,isovaleric amide,isopentanamide,beta-methylbutyramide,isovaleric acid amide,unii-9cp4kb634m,isovaleramide usan,.beta.-methylbutyramide PubChem CID: 10930 IUPAC Name: 3-methylbutanamide SMILES: CC(C)CC(=O)N
| PubChem CID | 10930 |
|---|---|
| CAS | 541-46-8 |
| Molecular Weight (g/mol) | 101.149 |
| MDL Number | MFCD00014807 |
| SMILES | CC(C)CC(=O)N |
| Synonym | isovaleramide,butanamide, 3-methyl,3-methylbutyramide,isovaleric amide,isopentanamide,beta-methylbutyramide,isovaleric acid amide,unii-9cp4kb634m,isovaleramide usan,.beta.-methylbutyramide |
| IUPAC Name | 3-methylbutanamide |
| InChI Key | SANOUVWGPVYVAV-UHFFFAOYSA-N |
| Molecular Formula | C5H11NO |
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 |
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 |
ethyle5-amino-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylate, 97%, Thermo Scientific™
CAS: 138907-68-3 Molecular Formula: C12H12FN3O2 Molecular Weight (g/mol): 249.25 MDL Number: MFCD00173917 InChI Key: RPPPCKSHIYWAPW-UHFFFAOYSA-N Synonym: ethyl 5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluorophenyl pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluoro-phenyl-1h-pyrazole-4-carboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylic acid ethyl ester,5-amino-4-ethoxycarbonyl-1-4-fluorophenyl-1h-pyrazole,1-5-amino-4-ethoxycarbonyl-1h-pyrazol-1-yl-4-fluorobenzene,maybridge1_006170,ethyl5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethylaminofluorophenylpyrazolecarboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxyli PubChem CID: 688689 IUPAC Name: ethyl 5-amino-1-(4-fluorophenyl)pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(N)N(N=C1)C1=CC=C(F)C=C1
| PubChem CID | 688689 |
|---|---|
| CAS | 138907-68-3 |
| Molecular Weight (g/mol) | 249.25 |
| MDL Number | MFCD00173917 |
| SMILES | CCOC(=O)C1=C(N)N(N=C1)C1=CC=C(F)C=C1 |
| Synonym | ethyl 5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluorophenyl pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluoro-phenyl-1h-pyrazole-4-carboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylic acid ethyl ester,5-amino-4-ethoxycarbonyl-1-4-fluorophenyl-1h-pyrazole,1-5-amino-4-ethoxycarbonyl-1h-pyrazol-1-yl-4-fluorobenzene,maybridge1_006170,ethyl5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethylaminofluorophenylpyrazolecarboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxyli |
| IUPAC Name | ethyl 5-amino-1-(4-fluorophenyl)pyrazole-4-carboxylate |
| InChI Key | RPPPCKSHIYWAPW-UHFFFAOYSA-N |
| Molecular Formula | C12H12FN3O2 |
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 |
Zinc trifluoromethanesulfonate, 98%
CAS: 54010-75-2 Molecular Formula: C2F6O6S2Zn Molecular Weight (g/mol): 363.51 MDL Number: MFCD00013229 InChI Key: CITILBVTAYEWKR-UHFFFAOYSA-L Synonym: zinc trifluoromethanesulfonate,zinc ii trifluoromethanesulfonate,zinc trifluoromethanesulphonate,zinc triflate,zinc ii triflate,zn otf 2,methanesulfonic acid, trifluoro-, zinc salt,zinc 2+ ion ditriflate,methanesulfonic acid, 1,1,1-trifluoro-, zinc salt 2:1,zinc ii trifluoromethanesulphonate PubChem CID: 104671 SMILES: [Zn++].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F
| PubChem CID | 104671 |
|---|---|
| CAS | 54010-75-2 |
| Molecular Weight (g/mol) | 363.51 |
| MDL Number | MFCD00013229 |
| SMILES | [Zn++].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F |
| Synonym | zinc trifluoromethanesulfonate,zinc ii trifluoromethanesulfonate,zinc trifluoromethanesulphonate,zinc triflate,zinc ii triflate,zn otf 2,methanesulfonic acid, trifluoro-, zinc salt,zinc 2+ ion ditriflate,methanesulfonic acid, 1,1,1-trifluoro-, zinc salt 2:1,zinc ii trifluoromethanesulphonate |
| InChI Key | CITILBVTAYEWKR-UHFFFAOYSA-L |
| Molecular Formula | C2F6O6S2Zn |
4-Amino-5-imidazolecarboxamide hydrochloride, 98%
CAS: 72-40-2 Molecular Formula: C4H7ClN4O Molecular Weight (g/mol): 162.58 MDL Number: MFCD00012704 InChI Key: MXCUYSMIELHIQL-UHFFFAOYSA-N Synonym: 4-amino-5-imidazolecarboxamide hydrochloride,5-amino-4-imidazolecarboxamide hydrochloride,5-amino-1h-imidazole-4-carboxamide hydrochloride,5-aminoimidazole-4-carboxamide hydrochloride,aic .cntdot. hcl,4-amino-1h-imidazole-5-carboxamide hydrochloride,aminoimidazolecarboxamide hydrochloride,4-aminoimidazole-5-carboxamide hydrochloride,1h-imidazole-4-carboxamide, 5-amino-, monohydrochloride,5-aminoimidazol-4-carboxamide, hydrochloride PubChem CID: 66146 IUPAC Name: 4-amino-1H-imidazole-5-carboxamide;hydrochloride SMILES: Cl.NC(=O)C1=C(N)N=CN1
| PubChem CID | 66146 |
|---|---|
| CAS | 72-40-2 |
| Molecular Weight (g/mol) | 162.58 |
| MDL Number | MFCD00012704 |
| SMILES | Cl.NC(=O)C1=C(N)N=CN1 |
| Synonym | 4-amino-5-imidazolecarboxamide hydrochloride,5-amino-4-imidazolecarboxamide hydrochloride,5-amino-1h-imidazole-4-carboxamide hydrochloride,5-aminoimidazole-4-carboxamide hydrochloride,aic .cntdot. hcl,4-amino-1h-imidazole-5-carboxamide hydrochloride,aminoimidazolecarboxamide hydrochloride,4-aminoimidazole-5-carboxamide hydrochloride,1h-imidazole-4-carboxamide, 5-amino-, monohydrochloride,5-aminoimidazol-4-carboxamide, hydrochloride |
| IUPAC Name | 4-amino-1H-imidazole-5-carboxamide;hydrochloride |
| InChI Key | MXCUYSMIELHIQL-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClN4O |
Ethyl formate, 97%
CAS: 109-94-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00003294 InChI Key: WBJINCZRORDGAQ-UHFFFAOYSA-N Synonym: areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat PubChem CID: 8025 ChEBI: CHEBI:52342 IUPAC Name: ethyl formate SMILES: CCOC=O
| PubChem CID | 8025 |
|---|---|
| CAS | 109-94-4 |
| Molecular Weight (g/mol) | 74.08 |
| ChEBI | CHEBI:52342 |
| MDL Number | MFCD00003294 |
| SMILES | CCOC=O |
| Synonym | areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat |
| IUPAC Name | ethyl formate |
| InChI Key | WBJINCZRORDGAQ-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
Gluconic acid, potassium salt, 99%
Molecular Formula: C6H11KO7 Molecular Weight (g/mol): 234.25 MDL Number: MFCD00064211 InChI Key: HLCFGWHYROZGBI-JJKGCWMISA-M Synonym: potassium gluconate,potassium d-gluconate,gluconic acid potassium salt,potassuril,kaon elixir,potassium 2r,3s,4r,5r-2,3,4,5,6-pentahydroxyhexanoate,katorin,potalium,potasoral,sirokal PubChem CID: 16760467 IUPAC Name: potassium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate SMILES: C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[K+]
| PubChem CID | 16760467 |
|---|---|
| Molecular Weight (g/mol) | 234.25 |
| MDL Number | MFCD00064211 |
| SMILES | C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[K+] |
| Synonym | potassium gluconate,potassium d-gluconate,gluconic acid potassium salt,potassuril,kaon elixir,potassium 2r,3s,4r,5r-2,3,4,5,6-pentahydroxyhexanoate,katorin,potalium,potasoral,sirokal |
| IUPAC Name | potassium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate |
| InChI Key | HLCFGWHYROZGBI-JJKGCWMISA-M |
| Molecular Formula | C6H11KO7 |
Vinyl acetate, 99%, stab. with 8-12ppm hydroquinone
CAS: 108-05-4 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00008713 InChI Key: XTXRWKRVRITETP-UHFFFAOYSA-N Synonym: vinyl acetate,acetic acid ethenyl ester,acetic acid vinyl ester,ethenyl ethanoate,1-acetoxyethylene,vinyl ethanoate,acetoxyethene,vinylacetat,vinyl acetate monomer,vinyl a monomer PubChem CID: 7904 ChEBI: CHEBI:46916 IUPAC Name: ethenyl acetate SMILES: CC(=O)OC=C
| PubChem CID | 7904 |
|---|---|
| CAS | 108-05-4 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:46916 |
| MDL Number | MFCD00008713 |
| SMILES | CC(=O)OC=C |
| Synonym | vinyl acetate,acetic acid ethenyl ester,acetic acid vinyl ester,ethenyl ethanoate,1-acetoxyethylene,vinyl ethanoate,acetoxyethene,vinylacetat,vinyl acetate monomer,vinyl a monomer |
| IUPAC Name | ethenyl acetate |
| InChI Key | XTXRWKRVRITETP-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
Benzoyleneurea, 98%
CAS: 86-96-4 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00006699 InChI Key: SDQJTWBNWQABLE-UHFFFAOYSA-N Synonym: benzoyleneurea,quinazoline-2,4 1h,3h-dione,2,4 1h,3h-quinazolinedione,quinazoline-2,4-diol,2,4-dihydroxyquinazoline,quinazolinedione,benzouracil,quinazoline-2,4-dione,urea, benzoylene,1,2,3,4-tetrahydroquinazoline-2,4-dione PubChem CID: 64048 IUPAC Name: 1H-quinazoline-2,4-dione SMILES: C1=CC=C2C(=C1)C(=O)NC(=O)N2
| PubChem CID | 64048 |
|---|---|
| CAS | 86-96-4 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00006699 |
| SMILES | C1=CC=C2C(=C1)C(=O)NC(=O)N2 |
| Synonym | benzoyleneurea,quinazoline-2,4 1h,3h-dione,2,4 1h,3h-quinazolinedione,quinazoline-2,4-diol,2,4-dihydroxyquinazoline,quinazolinedione,benzouracil,quinazoline-2,4-dione,urea, benzoylene,1,2,3,4-tetrahydroquinazoline-2,4-dione |
| IUPAC Name | 1H-quinazoline-2,4-dione |
| InChI Key | SDQJTWBNWQABLE-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
2-Cyclopentene-1-acetic acid, tech. 90%, remainder mainly 3-cyclopentene-1-acetic acid
CAS: 13668-61-6 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00001400 InChI Key: NNRZTJAACCRFRV-UHFFFAOYSA-N Synonym: 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid PubChem CID: 96216 IUPAC Name: 2-cyclopent-2-en-1-ylacetic acid SMILES: C1CC(C=C1)CC(=O)O
| PubChem CID | 96216 |
|---|---|
| CAS | 13668-61-6 |
| Molecular Weight (g/mol) | 126.155 |
| MDL Number | MFCD00001400 |
| SMILES | C1CC(C=C1)CC(=O)O |
| Synonym | 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid |
| IUPAC Name | 2-cyclopent-2-en-1-ylacetic acid |
| InChI Key | NNRZTJAACCRFRV-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |