Organic acids and derivatives
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Tamoxifen Citrate, USP, 99-101%, Spectrum™ Chemical
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CAS: 54965-24-1 Molecular Formula: C32H37NO8 Molecular Weight (g/mol): 563.65 MDL Number: MFCD00058321 InChI Key: FQZYTYWMLGAPFJ-OQKDUQJOSA-N IUPAC Name: (2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethyl)dimethylamine; 2-hydroxypropane-1,2,3-tricarboxylic acid SMILES: OC(=O)CC(O)(CC(O)=O)C(O)=O.CC\C(=C(/C1=CC=CC=C1)C1=CC=C(OCCN(C)C)C=C1)C1=CC=CC=C1
| CAS | 54965-24-1 |
|---|---|
| Molecular Weight (g/mol) | 563.65 |
| MDL Number | MFCD00058321 |
| SMILES | OC(=O)CC(O)(CC(O)=O)C(O)=O.CC\C(=C(/C1=CC=CC=C1)C1=CC=C(OCCN(C)C)C=C1)C1=CC=CC=C1 |
| IUPAC Name | (2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethyl)dimethylamine; 2-hydroxypropane-1,2,3-tricarboxylic acid |
| InChI Key | FQZYTYWMLGAPFJ-OQKDUQJOSA-N |
| Molecular Formula | C32H37NO8 |
cis-1,2,3,6-Tetrahydrophthalimide, 96%, Thermo Scientific™
CAS: 1469-48-3 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.16 MDL Number: MFCD00005880 InChI Key: CIFFBTOJCKSRJY-OLQVQODUSA-N Synonym: cis-1,2,3,6-tetrahydrophthalimide,cis-3a,4,7,7a-tetrahydro-1h-isoindole-1,3 2h-dione,cis-4-cyclohexene-1,2-dicarboximide,cis-tetrahydrophthalimide,unii-es57d28o1u,4-cyclohexene-1,2-dicarboximide, cis,cis-.delta.4-tetrahydrophthalimide,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, cis,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, 3ar,7as-rel,3ar,7as-3a,4,7,7a-tetrahydroisoindole-1,3-dione PubChem CID: 92888 IUPAC Name: (3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione SMILES: C1C=CCC2C1C(=O)NC2=O
| PubChem CID | 92888 |
|---|---|
| CAS | 1469-48-3 |
| Molecular Weight (g/mol) | 151.16 |
| MDL Number | MFCD00005880 |
| SMILES | C1C=CCC2C1C(=O)NC2=O |
| Synonym | cis-1,2,3,6-tetrahydrophthalimide,cis-3a,4,7,7a-tetrahydro-1h-isoindole-1,3 2h-dione,cis-4-cyclohexene-1,2-dicarboximide,cis-tetrahydrophthalimide,unii-es57d28o1u,4-cyclohexene-1,2-dicarboximide, cis,cis-.delta.4-tetrahydrophthalimide,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, cis,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, 3ar,7as-rel,3ar,7as-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| IUPAC Name | (3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| InChI Key | CIFFBTOJCKSRJY-OLQVQODUSA-N |
| Molecular Formula | C8H9NO2 |
5-Hexenyl acetate, 97%
CAS: 5048-26-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00060856 InChI Key: MPLWNENKBSBMFN-UHFFFAOYSA-N Synonym: 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j PubChem CID: 537536 IUPAC Name: hex-5-enyl acetate SMILES: CC(=O)OCCCCC=C
| PubChem CID | 537536 |
|---|---|
| CAS | 5048-26-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00060856 |
| SMILES | CC(=O)OCCCCC=C |
| Synonym | 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j |
| IUPAC Name | hex-5-enyl acetate |
| InChI Key | MPLWNENKBSBMFN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Sodium Lactate Solution, FCC, 60%, Spectrum™ Chemical
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Molecular Formula: C3H5NaO3 Molecular Weight (g/mol): 112.06 InChI Key: NGSFWBMYFKHRBD-UHFFFAOYNA-M IUPAC Name: sodium 2-hydroxypropanoate SMILES: [Na+].CC(O)C([O-])=O
| Molecular Weight (g/mol) | 112.06 |
|---|---|
| SMILES | [Na+].CC(O)C([O-])=O |
| IUPAC Name | sodium 2-hydroxypropanoate |
| InChI Key | NGSFWBMYFKHRBD-UHFFFAOYNA-M |
| Molecular Formula | C3H5NaO3 |
Sodium Tartrate, Dihydrate, Crystal, Reagent, ACS, 99-101%, Spectrum™ Chemical
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CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L IUPAC Name: disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6106-24-7 |
|---|---|
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
Sodium 1-Octanesulfonate Monohydrate, 99+%
CAS: 207596-29-0 Molecular Formula: C8H19NaO4S Molecular Weight (g/mol): 234.29 MDL Number: MFCD00149551 InChI Key: MBURIAHQXJQKRE-UHFFFAOYSA-M Synonym: sodium octane-1-sulfonate hydrate,1-octanesulfonic acid sodium salt monohydrate,sodium 1-octanesulfonate monohydrate,1-octanesulfonic acid, sodium salt, monohydrate,sodium 1-octanesulfonate hydrate,1-octane sulfonic acid, na,acmc-20p1dl,ksc496c2b,sodium1-octanesulfonatemonohydrate,potassium hydrate octane-1-sulfonate PubChem CID: 23666339 IUPAC Name: sodium;octane-1-sulfonate;hydrate SMILES: O.[Na+].CCCCCCCCS([O-])(=O)=O
| PubChem CID | 23666339 |
|---|---|
| CAS | 207596-29-0 |
| Molecular Weight (g/mol) | 234.29 |
| MDL Number | MFCD00149551 |
| SMILES | O.[Na+].CCCCCCCCS([O-])(=O)=O |
| Synonym | sodium octane-1-sulfonate hydrate,1-octanesulfonic acid sodium salt monohydrate,sodium 1-octanesulfonate monohydrate,1-octanesulfonic acid, sodium salt, monohydrate,sodium 1-octanesulfonate hydrate,1-octane sulfonic acid, na,acmc-20p1dl,ksc496c2b,sodium1-octanesulfonatemonohydrate,potassium hydrate octane-1-sulfonate |
| IUPAC Name | sodium;octane-1-sulfonate;hydrate |
| InChI Key | MBURIAHQXJQKRE-UHFFFAOYSA-M |
| Molecular Formula | C8H19NaO4S |
1-Acetylindoline-5-sulfonyl chloride, 97%
CAS: 52206-05-0 Molecular Formula: C10H10ClNO3S Molecular Weight (g/mol): 259.70 MDL Number: MFCD07368558 InChI Key: QNFXLCHANYHGIF-UHFFFAOYSA-N Synonym: 1-acetyl-2,3-dihydro-1h-indole-5-sulfonyl chloride,1-acetylindoline-5-sulfonyl chloride,1-acetyl-5-indolinesulfonoyl chloride,1h-indole-5-sulfonyl chloride, 1-acetyl-2,3-dihydro,1-acetyl-5-indolinesulfonyl chloride,n-acetylindoline-5-sulphonyl chloride,1-acetyl-5-chlorosulfonyl indoline,1-acetylindoline-5-sulfonylchloride,pubchem5449,acetylindolinesulfonoylchloride PubChem CID: 14024596 IUPAC Name: 1-acetyl-2,3-dihydroindole-5-sulfonyl chloride SMILES: CC(=O)N1CCC2=C1C=CC(=C2)S(Cl)(=O)=O
| PubChem CID | 14024596 |
|---|---|
| CAS | 52206-05-0 |
| Molecular Weight (g/mol) | 259.70 |
| MDL Number | MFCD07368558 |
| SMILES | CC(=O)N1CCC2=C1C=CC(=C2)S(Cl)(=O)=O |
| Synonym | 1-acetyl-2,3-dihydro-1h-indole-5-sulfonyl chloride,1-acetylindoline-5-sulfonyl chloride,1-acetyl-5-indolinesulfonoyl chloride,1h-indole-5-sulfonyl chloride, 1-acetyl-2,3-dihydro,1-acetyl-5-indolinesulfonyl chloride,n-acetylindoline-5-sulphonyl chloride,1-acetyl-5-chlorosulfonyl indoline,1-acetylindoline-5-sulfonylchloride,pubchem5449,acetylindolinesulfonoylchloride |
| IUPAC Name | 1-acetyl-2,3-dihydroindole-5-sulfonyl chloride |
| InChI Key | QNFXLCHANYHGIF-UHFFFAOYSA-N |
| Molecular Formula | C10H10ClNO3S |
Sodium 2-bromoethanesulfonate, 98%
CAS: 4263-52-9 Molecular Formula: C2H4BrNaO3S Molecular Weight (g/mol): 211.005 MDL Number: MFCD00007530 InChI Key: HNFOAHXBHLWKNF-UHFFFAOYSA-M Synonym: sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat PubChem CID: 23666797 IUPAC Name: sodium;2-bromoethanesulfonate SMILES: C(CBr)S(=O)(=O)[O-].[Na+]
| PubChem CID | 23666797 |
|---|---|
| CAS | 4263-52-9 |
| Molecular Weight (g/mol) | 211.005 |
| MDL Number | MFCD00007530 |
| SMILES | C(CBr)S(=O)(=O)[O-].[Na+] |
| Synonym | sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat |
| IUPAC Name | sodium;2-bromoethanesulfonate |
| InChI Key | HNFOAHXBHLWKNF-UHFFFAOYSA-M |
| Molecular Formula | C2H4BrNaO3S |
N-(2-Hydroxyethyl)succinimide, 95%
CAS: 18190-44-8 Molecular Formula: C6H9NO3 Molecular Weight (g/mol): 143.142 MDL Number: MFCD00078332 InChI Key: TWYIPMITVXPNEM-UHFFFAOYSA-N Synonym: n-2-hydroxyethyl succinimide,1-2-hydroxyethyl pyrrolidine-2,5-dione,2,5-pyrrolidinedione, 1-2-hydroxyethyl,1-2-hydroxyethyl-2,5-pyrrolidinedione,2,5-pyrrolidinedione,1-2-hydroxyethyl,acmc-20akck,2-hydroxyethylsuccinimide PubChem CID: 236334 IUPAC Name: 1-(2-hydroxyethyl)pyrrolidine-2,5-dione SMILES: C1CC(=O)N(C1=O)CCO
| PubChem CID | 236334 |
|---|---|
| CAS | 18190-44-8 |
| Molecular Weight (g/mol) | 143.142 |
| MDL Number | MFCD00078332 |
| SMILES | C1CC(=O)N(C1=O)CCO |
| Synonym | n-2-hydroxyethyl succinimide,1-2-hydroxyethyl pyrrolidine-2,5-dione,2,5-pyrrolidinedione, 1-2-hydroxyethyl,1-2-hydroxyethyl-2,5-pyrrolidinedione,2,5-pyrrolidinedione,1-2-hydroxyethyl,acmc-20akck,2-hydroxyethylsuccinimide |
| IUPAC Name | 1-(2-hydroxyethyl)pyrrolidine-2,5-dione |
| InChI Key | TWYIPMITVXPNEM-UHFFFAOYSA-N |
| Molecular Formula | C6H9NO3 |
Methyl pyruvate, 98%
CAS: 600-22-6 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00008754 InChI Key: CWKLZLBVOJRSOM-UHFFFAOYSA-N Synonym: methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester PubChem CID: 11748 ChEBI: CHEBI:51850 IUPAC Name: methyl 2-oxopropanoate SMILES: CC(=O)C(=O)OC
| PubChem CID | 11748 |
|---|---|
| CAS | 600-22-6 |
| Molecular Weight (g/mol) | 102.089 |
| ChEBI | CHEBI:51850 |
| MDL Number | MFCD00008754 |
| SMILES | CC(=O)C(=O)OC |
| Synonym | methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester |
| IUPAC Name | methyl 2-oxopropanoate |
| InChI Key | CWKLZLBVOJRSOM-UHFFFAOYSA-N |
| Molecular Formula | C4H6O3 |
1-Methyl-2-benzimidazolinone, 98%
CAS: 1849-01-0 Molecular Formula: C8H8N2O Molecular Weight (g/mol): 148.17 MDL Number: MFCD00142654 InChI Key: PYEHNKXDXBNHQQ-UHFFFAOYSA-N Synonym: 1-methyl-2-benzimidazolinone,1-methyl-1h-benzo d imidazol-2 3h-one,1-methyl-1,3-dihydro-2h-benzimidazol-2-one,1,3-dihydro-1-methyl-2h-benzimidazol-2-one,2h-benzimidazol-2-one, 1,3-dihydro-1-methyl,1-methyl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-methyl-3h-1,3-benzodiazol-2-one,n-methylbenzimidazolone,1-methylbenzimidazolone,n-methylbenzimidazolinone PubChem CID: 590540 IUPAC Name: 3-methyl-1H-benzimidazol-2-one SMILES: CN1C(=O)NC2=CC=CC=C12
| PubChem CID | 590540 |
|---|---|
| CAS | 1849-01-0 |
| Molecular Weight (g/mol) | 148.17 |
| MDL Number | MFCD00142654 |
| SMILES | CN1C(=O)NC2=CC=CC=C12 |
| Synonym | 1-methyl-2-benzimidazolinone,1-methyl-1h-benzo d imidazol-2 3h-one,1-methyl-1,3-dihydro-2h-benzimidazol-2-one,1,3-dihydro-1-methyl-2h-benzimidazol-2-one,2h-benzimidazol-2-one, 1,3-dihydro-1-methyl,1-methyl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-methyl-3h-1,3-benzodiazol-2-one,n-methylbenzimidazolone,1-methylbenzimidazolone,n-methylbenzimidazolinone |
| IUPAC Name | 3-methyl-1H-benzimidazol-2-one |
| InChI Key | PYEHNKXDXBNHQQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O |
Thermo Scientific Chemicals Spironolactone, 99%
CAS: 52-01-7 Molecular Formula: C24H32O4S Molecular Weight (g/mol): 416.57 MDL Number: MFCD00082250 InChI Key: LXMSZDCAJNLERA-ZHYRCANASA-N Synonym: spironolactone,aldactone,spirolactone,verospiron,euteberol,spiroctan,spirolang,verospirone,aldactone a,spironocompren PubChem CID: 5833 ChEBI: CHEBI:9241 IUPAC Name: S-[(7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5'-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-yl] ethanethioate SMILES: CC(=O)SC1CC2=CC(=O)CCC2(C3C1C4CCC5(C4(CC3)C)CCC(=O)O5)C
| PubChem CID | 5833 |
|---|---|
| CAS | 52-01-7 |
| Molecular Weight (g/mol) | 416.57 |
| ChEBI | CHEBI:9241 |
| MDL Number | MFCD00082250 |
| SMILES | CC(=O)SC1CC2=CC(=O)CCC2(C3C1C4CCC5(C4(CC3)C)CCC(=O)O5)C |
| Synonym | spironolactone,aldactone,spirolactone,verospiron,euteberol,spiroctan,spirolang,verospirone,aldactone a,spironocompren |
| IUPAC Name | S-[(7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5'-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-yl] ethanethioate |
| InChI Key | LXMSZDCAJNLERA-ZHYRCANASA-N |
| Molecular Formula | C24H32O4S |
Methyl diethylphosphonoacetate, 97%
CAS: 1067-74-9 Molecular Formula: C7H15O5P Molecular Weight (g/mol): 210.17 MDL Number: MFCD00009081 InChI Key: CTSAXXHOGZNKJR-UHFFFAOYSA-N Synonym: methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f PubChem CID: 66113 IUPAC Name: methyl 2-diethoxyphosphorylacetate SMILES: CCOP(=O)(CC(=O)OC)OCC
| PubChem CID | 66113 |
|---|---|
| CAS | 1067-74-9 |
| Molecular Weight (g/mol) | 210.17 |
| MDL Number | MFCD00009081 |
| SMILES | CCOP(=O)(CC(=O)OC)OCC |
| Synonym | methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f |
| IUPAC Name | methyl 2-diethoxyphosphorylacetate |
| InChI Key | CTSAXXHOGZNKJR-UHFFFAOYSA-N |
| Molecular Formula | C7H15O5P |
1-Decylboronic acid, 98%
CAS: 24464-63-9 Molecular Formula: C10H23BO2 Molecular Weight (g/mol): 186.102 MDL Number: MFCD01074638 InChI Key: TUTSEMMBKGBUGD-UHFFFAOYSA-N Synonym: n-decylboronic acid,boronic acid, decyl,decylboranic acid,n-decaneboronic acid,n-,boronicacid, b-decyl,1-decylboronic acid,ksc199m8d PubChem CID: 4186635 IUPAC Name: decylboronic acid SMILES: B(CCCCCCCCCC)(O)O
| PubChem CID | 4186635 |
|---|---|
| CAS | 24464-63-9 |
| Molecular Weight (g/mol) | 186.102 |
| MDL Number | MFCD01074638 |
| SMILES | B(CCCCCCCCCC)(O)O |
| Synonym | n-decylboronic acid,boronic acid, decyl,decylboranic acid,n-decaneboronic acid,n-,boronicacid, b-decyl,1-decylboronic acid,ksc199m8d |
| IUPAC Name | decylboronic acid |
| InChI Key | TUTSEMMBKGBUGD-UHFFFAOYSA-N |
| Molecular Formula | C10H23BO2 |
1,5-Dimethyl-1H-pyrazole-3-carboxylic acid, 95+%, Thermo Scientific™
CAS: 5744-59-2 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.14 MDL Number: MFCD00085040 InChI Key: PXRXGHUTKHXUGF-UHFFFAOYSA-N Synonym: 1,5-dimethyl-1h-pyrazole-3-carboxylic acid,1,5-dimethyl-1h-pyrazole-3-carboxylicacid,1,5-dimethyl-3-pyrazolecarboxylic acid,1h-pyrazole-3-carboxylic acid, 1,5-dimethyl,1,5-dimethyl-1h-pyrazole-3-carboxylic,acmc-209lyb,pyrazole-3-carboxylic acid, 1,5-dimethyl,1h-pyrazole-3-carboxylicacid, 1,5-dimethyl,1,5-dimethyl-1h-pyrazole-3-carboxylic acid # PubChem CID: 587757 SMILES: CN1N=C(C=C1C)C(O)=O
| PubChem CID | 587757 |
|---|---|
| CAS | 5744-59-2 |
| Molecular Weight (g/mol) | 140.14 |
| MDL Number | MFCD00085040 |
| SMILES | CN1N=C(C=C1C)C(O)=O |
| Synonym | 1,5-dimethyl-1h-pyrazole-3-carboxylic acid,1,5-dimethyl-1h-pyrazole-3-carboxylicacid,1,5-dimethyl-3-pyrazolecarboxylic acid,1h-pyrazole-3-carboxylic acid, 1,5-dimethyl,1,5-dimethyl-1h-pyrazole-3-carboxylic,acmc-209lyb,pyrazole-3-carboxylic acid, 1,5-dimethyl,1h-pyrazole-3-carboxylicacid, 1,5-dimethyl,1,5-dimethyl-1h-pyrazole-3-carboxylic acid # |
| InChI Key | PXRXGHUTKHXUGF-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |