
Carboxylic acids and derivatives















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Edetate Disodium, U.S.P., J.T. Baker™
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 IUPAC Name: disodium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate SMILES: O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O

PubChem CID | 44120005 |
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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 |
IUPAC Name | disodium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate |
InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
Molecular Formula | C10H18N2Na2O10 |
N,N-Dimethylformamide, 99.8%, for spectroscopy
CAS: 68-12-2 Molecular Formula: C3H7NO Molecular Weight (g/mol): 73.10 MDL Number: MFCD00003284 InChI Key: ZMXDDKWLCZADIW-UHFFFAOYSA-N Synonym: dimethylformamide,dimethyl formamide,n,n-dimethylmethanamide,n-formyldimethylamine,formamide, n,n-dimethyl,dmf,dimethylformamid,dimetilformamide,dwumetyloformamid,dmfa PubChem CID: 6228 ChEBI: CHEBI:17741 IUPAC Name: N,N-dimethylformamide SMILES: CN(C)C=O

PubChem CID | 6228 |
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CAS | 68-12-2 |
Molecular Weight (g/mol) | 73.10 |
ChEBI | CHEBI:17741 |
MDL Number | MFCD00003284 |
SMILES | CN(C)C=O |
Synonym | dimethylformamide,dimethyl formamide,n,n-dimethylmethanamide,n-formyldimethylamine,formamide, n,n-dimethyl,dmf,dimethylformamid,dimetilformamide,dwumetyloformamid,dmfa |
IUPAC Name | N,N-dimethylformamide |
InChI Key | ZMXDDKWLCZADIW-UHFFFAOYSA-N |
Molecular Formula | C3H7NO |
Thermo Scientific Chemicals beta-D-Ribofuranose 1,2,3,5-tetraacetate, 98+%
CAS: 13035-61-5 Molecular Formula: C13H18O9 Molecular Weight (g/mol): 318.27 MDL Number: MFCD00005358 InChI Key: IHNHAHWGVLXCCI-FDYHWXHSSA-N Synonym: beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d PubChem CID: 83064 IUPAC Name: [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C

PubChem CID | 83064 |
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CAS | 13035-61-5 |
Molecular Weight (g/mol) | 318.27 |
MDL Number | MFCD00005358 |
SMILES | CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C |
Synonym | beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d |
IUPAC Name | [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate |
InChI Key | IHNHAHWGVLXCCI-FDYHWXHSSA-N |
Molecular Formula | C13H18O9 |
m-Tolylacetic acid, 97%
CAS: 621-36-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00004340 InChI Key: GJMPSRSMBJLKKB-UHFFFAOYSA-N Synonym: 3-methylphenylacetic acid,m-tolylacetic acid,2-m-tolyl acetic acid,2-3-methylphenyl acetic acid,3-tolylacetic acid,m-methylphenylacetic acid,3-methylphenyl acetic acid,m-tolylaceticacid,benzeneacetic acid, 3-methyl,methyll 3-methylphenylacetate PubChem CID: 12121 IUPAC Name: 2-(3-methylphenyl)acetic acid SMILES: CC1=CC=CC(CC(O)=O)=C1

PubChem CID | 12121 |
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CAS | 621-36-3 |
Molecular Weight (g/mol) | 150.18 |
MDL Number | MFCD00004340 |
SMILES | CC1=CC=CC(CC(O)=O)=C1 |
Synonym | 3-methylphenylacetic acid,m-tolylacetic acid,2-m-tolyl acetic acid,2-3-methylphenyl acetic acid,3-tolylacetic acid,m-methylphenylacetic acid,3-methylphenyl acetic acid,m-tolylaceticacid,benzeneacetic acid, 3-methyl,methyll 3-methylphenylacetate |
IUPAC Name | 2-(3-methylphenyl)acetic acid |
InChI Key | GJMPSRSMBJLKKB-UHFFFAOYSA-N |
Molecular Formula | C9H10O2 |
2-Chloroacetamide, 98%
CAS: 79-07-2 Molecular Formula: C2H4ClNO Molecular Weight (g/mol): 93.51 MDL Number: MFCD00008027 InChI Key: VXIVSQZSERGHQP-UHFFFAOYSA-N Synonym: chloroacetamide,acetamide, 2-chloro,chloracetamide,2-chloroethanamide,microcide,mergal af,chloracetamid,usaf do-29,2-chloracetamide,2-chloro-acetamide PubChem CID: 6580 IUPAC Name: 2-chloroacetamide SMILES: NC(=O)CCl

PubChem CID | 6580 |
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CAS | 79-07-2 |
Molecular Weight (g/mol) | 93.51 |
MDL Number | MFCD00008027 |
SMILES | NC(=O)CCl |
Synonym | chloroacetamide,acetamide, 2-chloro,chloracetamide,2-chloroethanamide,microcide,mergal af,chloracetamid,usaf do-29,2-chloracetamide,2-chloro-acetamide |
IUPAC Name | 2-chloroacetamide |
InChI Key | VXIVSQZSERGHQP-UHFFFAOYSA-N |
Molecular Formula | C2H4ClNO |
Ethyl 3-methyl-2-oxobutyrate, 95%
CAS: 20201-24-5 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009122 InChI Key: CKTYYUQUWFEUCO-UHFFFAOYSA-N Synonym: ethyl 3-methyl-2-oxobutyrate,ethyl dimethylpyruvate,ethyl 2-oxo-3-methylbutanoate,butanoic acid, 3-methyl-2-oxo-, ethyl ester,acmc-20akzg,ketovaline ethyl ester,pubchem18179,ethyl3-methyl-2-oxobutanoate,ethyl 2-methyl-2-oxobutyrate,ethyl-3-methyl-2-oxobutanoate PubChem CID: 88406 IUPAC Name: ethyl 3-methyl-2-oxobutanoate SMILES: CCOC(=O)C(=O)C(C)C

PubChem CID | 88406 |
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CAS | 20201-24-5 |
Molecular Weight (g/mol) | 144.17 |
MDL Number | MFCD00009122 |
SMILES | CCOC(=O)C(=O)C(C)C |
Synonym | ethyl 3-methyl-2-oxobutyrate,ethyl dimethylpyruvate,ethyl 2-oxo-3-methylbutanoate,butanoic acid, 3-methyl-2-oxo-, ethyl ester,acmc-20akzg,ketovaline ethyl ester,pubchem18179,ethyl3-methyl-2-oxobutanoate,ethyl 2-methyl-2-oxobutyrate,ethyl-3-methyl-2-oxobutanoate |
IUPAC Name | ethyl 3-methyl-2-oxobutanoate |
InChI Key | CKTYYUQUWFEUCO-UHFFFAOYSA-N |
Molecular Formula | C7H12O3 |
Methyl 1-cyclohexene-1-carboxylate, 98%
CAS: 18448-47-0 MDL Number: MFCD00001544 InChI Key: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonym: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene PubChem CID: 87647 IUPAC Name: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1

PubChem CID | 87647 |
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CAS | 18448-47-0 |
MDL Number | MFCD00001544 |
SMILES | COC(=O)C1=CCCCC1 |
Synonym | methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene |
IUPAC Name | methyl cyclohexene-1-carboxylate |
InChI Key | KXPWRCPEMHIZGU-UHFFFAOYSA-N |
Methyl 3-bromopropionate, 97%
CAS: 3395-91-3 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00000250 InChI Key: KQEVIFKPZOGBMZ-UHFFFAOYSA-N Synonym: methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester PubChem CID: 76934 IUPAC Name: methyl 3-bromopropanoate SMILES: COC(=O)CCBr

PubChem CID | 76934 |
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CAS | 3395-91-3 |
Molecular Weight (g/mol) | 167.00 |
MDL Number | MFCD00000250 |
SMILES | COC(=O)CCBr |
Synonym | methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester |
IUPAC Name | methyl 3-bromopropanoate |
InChI Key | KQEVIFKPZOGBMZ-UHFFFAOYSA-N |
Molecular Formula | C4H7BrO2 |
Isopropenyl acetate, 99%
CAS: 108-22-5 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008709 InChI Key: HETCEOQFVDFGSY-UHFFFAOYSA-N Synonym: isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate PubChem CID: 7916 IUPAC Name: prop-1-en-2-yl acetate SMILES: CC(=C)OC(C)=O

PubChem CID | 7916 |
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CAS | 108-22-5 |
Molecular Weight (g/mol) | 100.12 |
MDL Number | MFCD00008709 |
SMILES | CC(=C)OC(C)=O |
Synonym | isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate |
IUPAC Name | prop-1-en-2-yl acetate |
InChI Key | HETCEOQFVDFGSY-UHFFFAOYSA-N |
Molecular Formula | C5H8O2 |
trans-1,2-Diaminocyclohexane-N,N,N',N'-tetraacetic Acid Monohydrate, 98%
CAS: 125572-95-4 Molecular Formula: C14H20N2O8 Molecular Weight (g/mol): 344.32 MDL Number: MFCD00149243,MFCD00066429,MFCD00003845 InChI Key: FCKYPQBAHLOOJQ-NXEZZACHSA-L Synonym: 2,2',2,2'-trans-cyclohexane-1,2-diylbis azanetriyl tetraacetic acid hydrate,dcyta,trans-1,2-diaminocyclohexane-n,n,n',n'-tetraacetic acid monohydrate,1,2-cyclohexanedinitrilotetraacetic acid,2,2',2,2'-1r,2r-rel-cyclohexane-1,2-diylbis azanetriyl tetraacetic acid hydrate,trans-1,2-cyclohexanediaminetetraacetic acid monohydrate,cdta monohydrate,ctda monohydrate,chel-cd,chel r-cd PubChem CID: 2723844 SMILES: [O-]C(=O)C[NH+](CC([O-])=O)[C@@H]1CCCC[C@H]1[NH+](CC([O-])=O)CC([O-])=O

PubChem CID | 2723844 |
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CAS | 125572-95-4 |
Molecular Weight (g/mol) | 344.32 |
MDL Number | MFCD00149243,MFCD00066429,MFCD00003845 |
SMILES | [O-]C(=O)C[NH+](CC([O-])=O)[C@@H]1CCCC[C@H]1[NH+](CC([O-])=O)CC([O-])=O |
Synonym | 2,2',2,2'-trans-cyclohexane-1,2-diylbis azanetriyl tetraacetic acid hydrate,dcyta,trans-1,2-diaminocyclohexane-n,n,n',n'-tetraacetic acid monohydrate,1,2-cyclohexanedinitrilotetraacetic acid,2,2',2,2'-1r,2r-rel-cyclohexane-1,2-diylbis azanetriyl tetraacetic acid hydrate,trans-1,2-cyclohexanediaminetetraacetic acid monohydrate,cdta monohydrate,ctda monohydrate,chel-cd,chel r-cd |
InChI Key | FCKYPQBAHLOOJQ-NXEZZACHSA-L |
Molecular Formula | C14H20N2O8 |
Fusaric acid, 99%
CAS: 536-69-6 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.22 MDL Number: MFCD00006298 InChI Key: DGMPVYSXXIOGJY-UHFFFAOYSA-N Synonym: fusaric acid,5-butylpicolinic acid,fusarinic acid,2-pyridinecarboxylic acid, 5-butyl,5-butyl-2-pyridinecarboxylic acid,picolinic acid, 5-butyl,5-n-butylpyridine-2-carboxylic acid,unii-jwj963070n,5-butylpyridine-3-carboxylic acid,5-butyl-pyridine-2-carboxylic acid PubChem CID: 3442 ChEBI: CHEBI:5199 IUPAC Name: 5-butylpyridine-2-carboxylic acid SMILES: CCCCC1=CN=C(C=C1)C(=O)O

PubChem CID | 3442 |
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CAS | 536-69-6 |
Molecular Weight (g/mol) | 179.22 |
ChEBI | CHEBI:5199 |
MDL Number | MFCD00006298 |
SMILES | CCCCC1=CN=C(C=C1)C(=O)O |
Synonym | fusaric acid,5-butylpicolinic acid,fusarinic acid,2-pyridinecarboxylic acid, 5-butyl,5-butyl-2-pyridinecarboxylic acid,picolinic acid, 5-butyl,5-n-butylpyridine-2-carboxylic acid,unii-jwj963070n,5-butylpyridine-3-carboxylic acid,5-butyl-pyridine-2-carboxylic acid |
IUPAC Name | 5-butylpyridine-2-carboxylic acid |
InChI Key | DGMPVYSXXIOGJY-UHFFFAOYSA-N |
Molecular Formula | C10H13NO2 |
Ethyl phenylcyanoacetate, 97%
CAS: 4553-07-5 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00001866 InChI Key: SXIRJEDGTAKGKU-UHFFFAOYNA-N SMILES: CCOC(=O)C(C#N)C1=CC=CC=C1

CAS | 4553-07-5 |
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Molecular Weight (g/mol) | 189.21 |
MDL Number | MFCD00001866 |
SMILES | CCOC(=O)C(C#N)C1=CC=CC=C1 |
InChI Key | SXIRJEDGTAKGKU-UHFFFAOYNA-N |
Molecular Formula | C11H11NO2 |
4-Hydroxybenzoic Acid Hydrazide, 98%
CAS: 5351-23-5 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007605 InChI Key: ZMZGIVVRBMFZSG-UHFFFAOYSA-N Synonym: 4-hydroxybenzhydrazide,4-hydroxybenzoic acid hydrazide,4-hydroxybenzoic hydrazide,p-hydroxybenzhydrazide,p-hydroxybenzoic acid hydrazide,4-hydroxybenzoylhydrazine,benzoic acid, 4-hydroxy-, hydrazide,p-hydroxybenzoic hydrazide,p-hydroxybenzoyl hydrazine,4-hydroxy-benzoic acid hydrazide PubChem CID: 1742 IUPAC Name: 4-hydroxybenzohydrazide SMILES: C1=CC(=CC=C1C(=O)NN)O

PubChem CID | 1742 |
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CAS | 5351-23-5 |
Molecular Weight (g/mol) | 152.15 |
MDL Number | MFCD00007605 |
SMILES | C1=CC(=CC=C1C(=O)NN)O |
Synonym | 4-hydroxybenzhydrazide,4-hydroxybenzoic acid hydrazide,4-hydroxybenzoic hydrazide,p-hydroxybenzhydrazide,p-hydroxybenzoic acid hydrazide,4-hydroxybenzoylhydrazine,benzoic acid, 4-hydroxy-, hydrazide,p-hydroxybenzoic hydrazide,p-hydroxybenzoyl hydrazine,4-hydroxy-benzoic acid hydrazide |
IUPAC Name | 4-hydroxybenzohydrazide |
InChI Key | ZMZGIVVRBMFZSG-UHFFFAOYSA-N |
Molecular Formula | C7H8N2O2 |
5,5-Dimethylhydantoin, 97%
CAS: 77-71-4 Molecular Formula: C5H8N2O2 Molecular Weight (g/mol): 128.13 MDL Number: MFCD00005266 InChI Key: YIROYDNZEPTFOL-UHFFFAOYSA-N Synonym: 5,5-dimethylhydantoin,dimethylhydantoin,dm hydantoin,dantoin dmh,2,4-imidazolidinedione, 5,5-dimethyl,5,5-dimethyl-2,4-imidazolidinedione,dantoin 736,hydantoin, 5,5-dimethyl,5,5-dimethylhydantoin dmh,5,5-dimethyl hydantoin PubChem CID: 6491 IUPAC Name: 5,5-dimethylimidazolidine-2,4-dione SMILES: CC1(C)NC(=O)NC1=O

PubChem CID | 6491 |
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CAS | 77-71-4 |
Molecular Weight (g/mol) | 128.13 |
MDL Number | MFCD00005266 |
SMILES | CC1(C)NC(=O)NC1=O |
Synonym | 5,5-dimethylhydantoin,dimethylhydantoin,dm hydantoin,dantoin dmh,2,4-imidazolidinedione, 5,5-dimethyl,5,5-dimethyl-2,4-imidazolidinedione,dantoin 736,hydantoin, 5,5-dimethyl,5,5-dimethylhydantoin dmh,5,5-dimethyl hydantoin |
IUPAC Name | 5,5-dimethylimidazolidine-2,4-dione |
InChI Key | YIROYDNZEPTFOL-UHFFFAOYSA-N |
Molecular Formula | C5H8N2O2 |
N-Methylformanilide, 99%
CAS: 93-61-8 MDL Number: MFCD00003283 InChI Key: JIKUXBYRTXDNIY-UHFFFAOYSA-N Synonym: n-methylformanilide,formamide, n-methyl-n-phenyl,n-formyl-n-methylaniline,formanilide, n-methyl,methylphenylformamide,n-phenyl-n-methylformamide,n-methyl-n-formylaniline,n-methylformanilid,methyl phenyl formamide,n-methyl-n-phenyl-formamide PubChem CID: 66737 IUPAC Name: N-methyl-N-phenylformamide SMILES: CN(C=O)C1=CC=CC=C1

PubChem CID | 66737 |
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CAS | 93-61-8 |
MDL Number | MFCD00003283 |
SMILES | CN(C=O)C1=CC=CC=C1 |
Synonym | n-methylformanilide,formamide, n-methyl-n-phenyl,n-formyl-n-methylaniline,formanilide, n-methyl,methylphenylformamide,n-phenyl-n-methylformamide,n-methyl-n-formylaniline,n-methylformanilid,methyl phenyl formamide,n-methyl-n-phenyl-formamide |
IUPAC Name | N-methyl-N-phenylformamide |
InChI Key | JIKUXBYRTXDNIY-UHFFFAOYSA-N |