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Organic acids and derivatives

Organic compounds with acidic properties, and will commonly have carboxylic acids or similar functional groups in their structure. Derived compounds are also included.
Carboxylic acids and derivatives (11,896)
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1,981 – 1,995 of 22,273 results
1,981
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1-Hexylboronic acid, 97%

CAS: 16343-08-1 Molecular Formula: C6H15BO2 Molecular Weight (g/mol): 129.994 MDL Number: MFCD01074641 InChI Key: CXSYDLCMCLCOCA-UHFFFAOYSA-N Synonym: n-hexylboronic acid,1-hexaneboronic acid,boronic acid, b-hexyl,1-hexylboronic acid,n-hexaneboronic acid,boronic acid, hexyl,b-hexyl-boronic acid,n-hexylboronicacid,1-hexylboronic acid c6-b oh 2 PubChem CID: 351064 IUPAC Name: hexylboronic acid SMILES: B(CCCCCC)(O)O

PubChem CID 351064
CAS 16343-08-1
Molecular Weight (g/mol) 129.994
MDL Number MFCD01074641
SMILES B(CCCCCC)(O)O
Synonym n-hexylboronic acid,1-hexaneboronic acid,boronic acid, b-hexyl,1-hexylboronic acid,n-hexaneboronic acid,boronic acid, hexyl,b-hexyl-boronic acid,n-hexylboronicacid,1-hexylboronic acid c6-b oh 2
IUPAC Name hexylboronic acid
InChI Key CXSYDLCMCLCOCA-UHFFFAOYSA-N
Molecular Formula C6H15BO2
1,982
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Ethylurea, 98%

CAS: 625-52-5 Molecular Formula: C3H8N2O Molecular Weight (g/mol): 88.11 MDL Number: MFCD00007953 InChI Key: RYECOJGRJDOGPP-UHFFFAOYSA-N Synonym: 1-ethylurea,n-ethylurea,urea, ethyl,urea, 1-ethyl,polyurethane,urea, n-ethyl,ethyl urea,pellethane,athylisoharnstoff PubChem CID: 12254 IUPAC Name: ethylurea SMILES: CCNC(N)=O

PubChem CID 12254
CAS 625-52-5
Molecular Weight (g/mol) 88.11
MDL Number MFCD00007953
SMILES CCNC(N)=O
Synonym 1-ethylurea,n-ethylurea,urea, ethyl,urea, 1-ethyl,polyurethane,urea, n-ethyl,ethyl urea,pellethane,athylisoharnstoff
IUPAC Name ethylurea
InChI Key RYECOJGRJDOGPP-UHFFFAOYSA-N
Molecular Formula C3H8N2O
1,983

Pyridoxal-5-Phosphate Monohydrate, Approx. 98%, MP Biomedicals™

CAS: 41468-25-1 Molecular Formula: C8H10NO6P Molecular Weight (g/mol): 247.14 MDL Number: MFCD00006333 InChI Key: NGVDGCNFYWLIFO-UHFFFAOYSA-N Synonym: 4-formyl-5-hydroxy-6-methylpyridin-3-yl methyl dihydrogen phosphate hydrate,pyridoxal phosphate hydrate,pyridoxal 5-phosphate monohydrate,phosphopyridoxal monohydrate,pyridoxyl phosphate monohydrate,unii-5v5ioj8338,pyridoxal-5-phosphate, monohydrate,pyridoxal-5'-phosphate monohydrate,pyridoxal-5-phosphate monohydrate,pyridoxal 5'-phosphate monohydrate PubChem CID: 38882 IUPAC Name: [(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy]phosphonic acid SMILES: CC1=NC=C(COP(O)(O)=O)C(C=O)=C1O

PubChem CID 38882
CAS 41468-25-1
Molecular Weight (g/mol) 247.14
MDL Number MFCD00006333
SMILES CC1=NC=C(COP(O)(O)=O)C(C=O)=C1O
Synonym 4-formyl-5-hydroxy-6-methylpyridin-3-yl methyl dihydrogen phosphate hydrate,pyridoxal phosphate hydrate,pyridoxal 5-phosphate monohydrate,phosphopyridoxal monohydrate,pyridoxyl phosphate monohydrate,unii-5v5ioj8338,pyridoxal-5-phosphate, monohydrate,pyridoxal-5'-phosphate monohydrate,pyridoxal-5-phosphate monohydrate,pyridoxal 5'-phosphate monohydrate
IUPAC Name [(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy]phosphonic acid
InChI Key NGVDGCNFYWLIFO-UHFFFAOYSA-N
Molecular Formula C8H10NO6P
1,984

Khellin, MP Biomedicals

CAS: 82-02-0 Molecular Formula: C14H12O5 Molecular Weight (g/mol): 260.245 InChI Key: HSMPDPBYAYSOBC-UHFFFAOYSA-N Synonym: khellin,visammin,amicardine,methafrone,coronin,amikellin,ammipuran,ammivisnagen,benecardin,corafurone PubChem CID: 3828 ChEBI: CHEBI:6133 IUPAC Name: 4,9-dimethoxy-7-methylfuro[3,2-g]chromen-5-one SMILES: CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC

PubChem CID 3828
CAS 82-02-0
Molecular Weight (g/mol) 260.245
ChEBI CHEBI:6133
SMILES CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC
Synonym khellin,visammin,amicardine,methafrone,coronin,amikellin,ammipuran,ammivisnagen,benecardin,corafurone
IUPAC Name 4,9-dimethoxy-7-methylfuro[3,2-g]chromen-5-one
InChI Key HSMPDPBYAYSOBC-UHFFFAOYSA-N
Molecular Formula C14H12O5
1,985
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N-[Tris(hydroxymethyl)methyl]acrylamide, 99%

CAS: 13880-05-2 Molecular Formula: C7H13NO4 Molecular Weight (g/mol): 175.18 MDL Number: MFCD00081045 InChI Key: MVBJSQCJPSRKSW-UHFFFAOYSA-N Synonym: n-tris hydroxymethyl methyl acrylamide,n-1,3-dihydroxy-2-hydroxymethyl propan-2-yl acrylamide,tris-acrylamide,n-acryloyltris hydroxymethyl aminomethane,n-acryloyl-tris hydroxymethyl aminomethane,n-1,3-dihydroxy-2-hydroxymethyl propan-2-yl prop-2-enamide,zlchem 121,acryloylaminomethylidynetrimethanol,n-1,3-dihydroxy-2-hydroxymethyl-2-propanyl acrylamide PubChem CID: 83788 IUPAC Name: N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]prop-2-enamide SMILES: OCC(CO)(CO)NC(=O)C=C

PubChem CID 83788
CAS 13880-05-2
Molecular Weight (g/mol) 175.18
MDL Number MFCD00081045
SMILES OCC(CO)(CO)NC(=O)C=C
Synonym n-tris hydroxymethyl methyl acrylamide,n-1,3-dihydroxy-2-hydroxymethyl propan-2-yl acrylamide,tris-acrylamide,n-acryloyltris hydroxymethyl aminomethane,n-acryloyl-tris hydroxymethyl aminomethane,n-1,3-dihydroxy-2-hydroxymethyl propan-2-yl prop-2-enamide,zlchem 121,acryloylaminomethylidynetrimethanol,n-1,3-dihydroxy-2-hydroxymethyl-2-propanyl acrylamide
IUPAC Name N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]prop-2-enamide
InChI Key MVBJSQCJPSRKSW-UHFFFAOYSA-N
Molecular Formula C7H13NO4
1,986
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2,4,6-Trimethylbenzeneboronic acid, 97%

CAS: 5980-97-2 Molecular Formula: C9H13BO2 Molecular Weight (g/mol): 164.011 MDL Number: MFCD00236060 InChI Key: BZXQRXJJJUZZAJ-UHFFFAOYSA-N Synonym: mesitylboronic acid,2,4,6-trimethylbenzeneboronic acid,2-mesityleneboronic acid,2,4,6-trimethylphenyl boronic acid,2,4,6-trimethylphenyl boranediol,boronic acid, 2,4,6-trimethylphenyl,2,4,6-trimethylboronic acid,boronic acid, b-2,4,6-trimethylphenyl,mesityl boronic acid,pubchem7895 PubChem CID: 292184 IUPAC Name: (2,4,6-trimethylphenyl)boronic acid SMILES: B(C1=C(C=C(C=C1C)C)C)(O)O

PubChem CID 292184
CAS 5980-97-2
Molecular Weight (g/mol) 164.011
MDL Number MFCD00236060
SMILES B(C1=C(C=C(C=C1C)C)C)(O)O
Synonym mesitylboronic acid,2,4,6-trimethylbenzeneboronic acid,2-mesityleneboronic acid,2,4,6-trimethylphenyl boronic acid,2,4,6-trimethylphenyl boranediol,boronic acid, 2,4,6-trimethylphenyl,2,4,6-trimethylboronic acid,boronic acid, b-2,4,6-trimethylphenyl,mesityl boronic acid,pubchem7895
IUPAC Name (2,4,6-trimethylphenyl)boronic acid
InChI Key BZXQRXJJJUZZAJ-UHFFFAOYSA-N
Molecular Formula C9H13BO2
1,987

Trimethylurea

CAS: 632-14-4 Molecular Formula: C4H10N2O Molecular Weight (g/mol): 102.14 MDL Number: MFCD00014868 InChI Key: COSWCAGTKRUTQV-UHFFFAOYSA-N Synonym: trimethylurea,n,n,n'-trimethylurea,urea, trimethyl,n,n'-dimethyl-n-methylurea,trimethylharnstoff,n,n',n'-trimethylurea,trimethylharnstoff german,urea, 1,1,3-trimethyl,unii-rmk4wz573b,urea, n,n,n'-trimethyl PubChem CID: 12435 IUPAC Name: 1,1,3-trimethylurea SMILES: CNC(=O)N(C)C

PubChem CID 12435
CAS 632-14-4
Molecular Weight (g/mol) 102.14
MDL Number MFCD00014868
SMILES CNC(=O)N(C)C
Synonym trimethylurea,n,n,n'-trimethylurea,urea, trimethyl,n,n'-dimethyl-n-methylurea,trimethylharnstoff,n,n',n'-trimethylurea,trimethylharnstoff german,urea, 1,1,3-trimethyl,unii-rmk4wz573b,urea, n,n,n'-trimethyl
IUPAC Name 1,1,3-trimethylurea
InChI Key COSWCAGTKRUTQV-UHFFFAOYSA-N
Molecular Formula C4H10N2O
1,988
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5-Phenyl-1H-pyrazole-4-carboxylic acid, 97%

CAS: 5504-65-4 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD06798067,MFCD03834501 InChI Key: LGTJKUYVFSBOMC-UHFFFAOYSA-N Synonym: 3-phenyl-1h-pyrazole-4-carboxylic acid,3-phenylpyrazole-4-carboxylic acid,3-phenyl-2h-pyrazole-4-carboxylic acid,5-phenylpyrazole-4-carboxylic acid PubChem CID: 4138562 IUPAC Name: 5-phenyl-1H-pyrazole-4-carboxylic acid SMILES: OC(=O)C1=C(NN=C1)C1=CC=CC=C1

PubChem CID 4138562
CAS 5504-65-4
Molecular Weight (g/mol) 188.19
MDL Number MFCD06798067,MFCD03834501
SMILES OC(=O)C1=C(NN=C1)C1=CC=CC=C1
Synonym 3-phenyl-1h-pyrazole-4-carboxylic acid,3-phenylpyrazole-4-carboxylic acid,3-phenyl-2h-pyrazole-4-carboxylic acid,5-phenylpyrazole-4-carboxylic acid
IUPAC Name 5-phenyl-1H-pyrazole-4-carboxylic acid
InChI Key LGTJKUYVFSBOMC-UHFFFAOYSA-N
Molecular Formula C10H8N2O2
1,989
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3-Aminobenzeneboronic acid, 98%

CAS: 30418-59-8 Molecular Formula: C6H8BNO2 Molecular Weight (g/mol): 136.945 MDL Number: MFCD00007755 InChI Key: JMZFEHDNIAQMNB-UHFFFAOYSA-N Synonym: 3-aminobenzeneboronic acid,3-aminophenyl boronic acid,m-aminophenylboronic acid,3-aminophenyl boranediol,m-aminophenyl boronic acid,3-amino phenylboronic acid,chembl20852,boronic acid, 3-aminophenyl,m-aminophenyl metaboric acid PubChem CID: 92269 IUPAC Name: (3-aminophenyl)boronic acid SMILES: B(C1=CC(=CC=C1)N)(O)O

PubChem CID 92269
CAS 30418-59-8
Molecular Weight (g/mol) 136.945
MDL Number MFCD00007755
SMILES B(C1=CC(=CC=C1)N)(O)O
Synonym 3-aminobenzeneboronic acid,3-aminophenyl boronic acid,m-aminophenylboronic acid,3-aminophenyl boranediol,m-aminophenyl boronic acid,3-amino phenylboronic acid,chembl20852,boronic acid, 3-aminophenyl,m-aminophenyl metaboric acid
IUPAC Name (3-aminophenyl)boronic acid
InChI Key JMZFEHDNIAQMNB-UHFFFAOYSA-N
Molecular Formula C6H8BNO2
1,990
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4-n-Butoxybenzeneboronic acid, 98%

CAS: 105365-51-3 Molecular Formula: C10H15BO3 Molecular Weight (g/mol): 194.04 MDL Number: MFCD03427054 InChI Key: QUPFQMXWFNJUNJ-UHFFFAOYSA-N Synonym: 4-n-butoxyphenylboronic acid,4-butoxyphenyl boronic acid,4-n-butoxyphenyl boronic acid,p-butoxyphenylboronic acid,4-butyloxyphenylboronic acid,4-n-butoxy benzeneboronic acid,4-butoxymethylboronic acid,boronic acid, 4-butoxyphenyl,pubchem9549,4-butoxybenzeneboronic acid PubChem CID: 3836310 IUPAC Name: (4-butoxyphenyl)boronic acid SMILES: CCCCOC1=CC=C(C=C1)B(O)O

PubChem CID 3836310
CAS 105365-51-3
Molecular Weight (g/mol) 194.04
MDL Number MFCD03427054
SMILES CCCCOC1=CC=C(C=C1)B(O)O
Synonym 4-n-butoxyphenylboronic acid,4-butoxyphenyl boronic acid,4-n-butoxyphenyl boronic acid,p-butoxyphenylboronic acid,4-butyloxyphenylboronic acid,4-n-butoxy benzeneboronic acid,4-butoxymethylboronic acid,boronic acid, 4-butoxyphenyl,pubchem9549,4-butoxybenzeneboronic acid
IUPAC Name (4-butoxyphenyl)boronic acid
InChI Key QUPFQMXWFNJUNJ-UHFFFAOYSA-N
Molecular Formula C10H15BO3
1,991

Edetate Disodium U.S.P., Macron Fine Chemicals™

CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037,MFCD00003541 InChI Key: OVBJJZOQPCKUOR-UHFFFAOYSA-L Synonym: edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs PubChem CID: 44120005 SMILES: O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O

PubChem CID 44120005
CAS 6381-92-6
Molecular Weight (g/mol) 372.24
MDL Number MFCD00150037,MFCD00003541
SMILES O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O
Synonym edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs
InChI Key OVBJJZOQPCKUOR-UHFFFAOYSA-L
Molecular Formula C10H18N2Na2O10
1,992
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2-Bromoacetamide, 98%

CAS: 683-57-8 Molecular Formula: C2H4BrNO Molecular Weight (g/mol): 137.96 MDL Number: MFCD00008025 InChI Key: JUIKUQOUMZUFQT-UHFFFAOYSA-N Synonym: bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@ PubChem CID: 69632 IUPAC Name: 2-bromoacetamide SMILES: C(C(=O)N)Br

PubChem CID 69632
CAS 683-57-8
Molecular Weight (g/mol) 137.96
MDL Number MFCD00008025
SMILES C(C(=O)N)Br
Synonym bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@
IUPAC Name 2-bromoacetamide
InChI Key JUIKUQOUMZUFQT-UHFFFAOYSA-N
Molecular Formula C2H4BrNO
1,993
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(+)-Dibenzoyl-L-tartaric anhydride, 98%

CAS: 64339-95-3 Molecular Formula: C18H12O7 Molecular Weight (g/mol): 340.29 MDL Number: MFCD00067102 InChI Key: OXIKRMSPXYQFOT-ZCWZLOQUNA-N Synonym: 3r,4r-2,5-dioxotetrahydrofuran-3,4-diyl dibenzoate,+-dibenzoyl-l-tartaric anhydride,2,5-furandione, 3,4-bis benzoyloxy dihydro-, 3r,4r,2-o,3-o-dibenzoyl-l-tartaric anhydride,3r,4r-2,5-dioxo-3,4-dibenzoyloxy-3,4-dihydrofuran,3r,4r-4-benzoyloxy-2,5-dioxooxolan-3-yl benzoate PubChem CID: 2733743 IUPAC Name: [(3R,4R)-4-benzoyloxy-2,5-dioxooxolan-3-yl] benzoate SMILES: O=C(O[C@@H]1[C@@H](OC(=O)C2=CC=CC=C2)C(=O)OC1=O)C1=CC=CC=C1

PubChem CID 2733743
CAS 64339-95-3
Molecular Weight (g/mol) 340.29
MDL Number MFCD00067102
SMILES O=C(O[C@@H]1[C@@H](OC(=O)C2=CC=CC=C2)C(=O)OC1=O)C1=CC=CC=C1
Synonym 3r,4r-2,5-dioxotetrahydrofuran-3,4-diyl dibenzoate,+-dibenzoyl-l-tartaric anhydride,2,5-furandione, 3,4-bis benzoyloxy dihydro-, 3r,4r,2-o,3-o-dibenzoyl-l-tartaric anhydride,3r,4r-2,5-dioxo-3,4-dibenzoyloxy-3,4-dihydrofuran,3r,4r-4-benzoyloxy-2,5-dioxooxolan-3-yl benzoate
IUPAC Name [(3R,4R)-4-benzoyloxy-2,5-dioxooxolan-3-yl] benzoate
InChI Key OXIKRMSPXYQFOT-ZCWZLOQUNA-N
Molecular Formula C18H12O7
1,994
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3-Trifluoromethoxyphenylboronic acid, 98%, Thermo Scientific™

CAS: 179113-90-7 Molecular Formula: C7H6BF3O3 Molecular Weight (g/mol): 205.93 MDL Number: MFCD01320697 InChI Key: UWDFWVLAHRQSKK-UHFFFAOYSA-N Synonym: 3-trifluoromethoxyphenylboronic acid,3-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boronic acid,3-trifluoromethoxy benzeneboronic acid,m-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boranediol,3-trifluoromethyloxy phenylboronic acid,boronic acid, 3-trifluoromethoxy phenyl PubChem CID: 2734385 IUPAC Name: [3-(trifluoromethoxy)phenyl]boronic acid SMILES: OB(O)C1=CC=CC(OC(F)(F)F)=C1

PubChem CID 2734385
CAS 179113-90-7
Molecular Weight (g/mol) 205.93
MDL Number MFCD01320697
SMILES OB(O)C1=CC=CC(OC(F)(F)F)=C1
Synonym 3-trifluoromethoxyphenylboronic acid,3-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boronic acid,3-trifluoromethoxy benzeneboronic acid,m-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boranediol,3-trifluoromethyloxy phenylboronic acid,boronic acid, 3-trifluoromethoxy phenyl
IUPAC Name [3-(trifluoromethoxy)phenyl]boronic acid
InChI Key UWDFWVLAHRQSKK-UHFFFAOYSA-N
Molecular Formula C7H6BF3O3
1,995
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Methyl (S)-(+)-3-hydroxybutyrate, 99%, Thermo Scientific™

CAS: 53562-86-0 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00064461 InChI Key: LDLDJEAVRNAEBW-UHFFFAOYNA-N Synonym: methyl s-+-3-hydroxybutyrate,s-methyl 3-hydroxybutanoate,methyl s-3-hydroxybutyrate,s-3-hydroxybutanoic acid methyl ester,unii-g10281a5ah,methyl 3s-3-hydroxybutanoate,butanoic acid, 3-hydroxy-, methyl ester, 3s,methyl-s-3-hydroxybutyrate,s-+-3-hydroxy-n-butyric acid methyl ester,s-3-hydroxybutyric acid methyl ester PubChem CID: 6950307 IUPAC Name: methyl (3S)-3-hydroxybutanoate SMILES: COC(=O)CC(C)O

PubChem CID 6950307
CAS 53562-86-0
Molecular Weight (g/mol) 118.13
MDL Number MFCD00064461
SMILES COC(=O)CC(C)O
Synonym methyl s-+-3-hydroxybutyrate,s-methyl 3-hydroxybutanoate,methyl s-3-hydroxybutyrate,s-3-hydroxybutanoic acid methyl ester,unii-g10281a5ah,methyl 3s-3-hydroxybutanoate,butanoic acid, 3-hydroxy-, methyl ester, 3s,methyl-s-3-hydroxybutyrate,s-+-3-hydroxy-n-butyric acid methyl ester,s-3-hydroxybutyric acid methyl ester
IUPAC Name methyl (3S)-3-hydroxybutanoate
InChI Key LDLDJEAVRNAEBW-UHFFFAOYNA-N
Molecular Formula C5H10O3