Organic acids and derivatives
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Dimethyl 4,4'-Biphenyldicarboxylate 98.0+%, TCI America™
CAS: 792-74-5 Molecular Formula: C16H14O4 Molecular Weight (g/mol): 270.28 MDL Number: MFCD00017201 InChI Key: BKRIRZXWWALTPU-UHFFFAOYSA-N Synonym: dimethyl 1,1'-biphenyl-4,4'-dicarboxylate,dimethyl biphenyl-4,4'-dicarboxylate,biphenyl dimethyl dicarboxylate,dimethyl 4,4'-biphenyldicarboxylate,1,1'-biphenyl-4,4'-dicarboxylic acid, dimethyl ester,unii-k61bxa0u9c,4,4'-biphenyldicarboxylic acid, dimethyl ester,k61bxa0u9c,methyl 4-4-methoxycarbonylphenyl benzoate,methyl 4-4-methoxycarbonyl phenyl benzoate PubChem CID: 13099 IUPAC Name: 4,4'-dimethyl [1,1'-biphenyl]-4,4'-dicarboxylate SMILES: COC(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)OC
| PubChem CID | 13099 |
|---|---|
| CAS | 792-74-5 |
| Molecular Weight (g/mol) | 270.28 |
| MDL Number | MFCD00017201 |
| SMILES | COC(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)OC |
| Synonym | dimethyl 1,1'-biphenyl-4,4'-dicarboxylate,dimethyl biphenyl-4,4'-dicarboxylate,biphenyl dimethyl dicarboxylate,dimethyl 4,4'-biphenyldicarboxylate,1,1'-biphenyl-4,4'-dicarboxylic acid, dimethyl ester,unii-k61bxa0u9c,4,4'-biphenyldicarboxylic acid, dimethyl ester,k61bxa0u9c,methyl 4-4-methoxycarbonylphenyl benzoate,methyl 4-4-methoxycarbonyl phenyl benzoate |
| IUPAC Name | 4,4'-dimethyl [1,1'-biphenyl]-4,4'-dicarboxylate |
| InChI Key | BKRIRZXWWALTPU-UHFFFAOYSA-N |
| Molecular Formula | C16H14O4 |
Methyl 3-Methylthiophene-2-carboxylate 97.0+%, TCI America™
CAS: 81452-54-2 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.20 MDL Number: MFCD00234332 InChI Key: BRWROFVPMUPMJQ-UHFFFAOYSA-N Synonym: methyl 3-methyl-2-thiophenecarboxylate,3-methylthiophene-2-carboxylic acid methyl ester,3-methyl-thiophene-2-carboxylic acid methyl ester,2-thiophenecarboxylic acid, 3-methyl-, methyl ester,methyl 3-methyl-thiophene-2-carboxylate,d methyl ester,3-methyl-thiophene-2-carboxylic acid,pubchem10098,pubchem22915,ksc495k9b PubChem CID: 580757 IUPAC Name: methyl 3-methylthiophene-2-carboxylate SMILES: COC(=O)C1=C(C)C=CS1
| PubChem CID | 580757 |
|---|---|
| CAS | 81452-54-2 |
| Molecular Weight (g/mol) | 156.20 |
| MDL Number | MFCD00234332 |
| SMILES | COC(=O)C1=C(C)C=CS1 |
| Synonym | methyl 3-methyl-2-thiophenecarboxylate,3-methylthiophene-2-carboxylic acid methyl ester,3-methyl-thiophene-2-carboxylic acid methyl ester,2-thiophenecarboxylic acid, 3-methyl-, methyl ester,methyl 3-methyl-thiophene-2-carboxylate,d methyl ester,3-methyl-thiophene-2-carboxylic acid,pubchem10098,pubchem22915,ksc495k9b |
| IUPAC Name | methyl 3-methylthiophene-2-carboxylate |
| InChI Key | BRWROFVPMUPMJQ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2S |
Methyl 3,3-Dimethoxypropionate 98.0+%, TCI America™
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.158 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N PubChem CID: 81924 IUPAC Name: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC
| PubChem CID | 81924 |
|---|---|
| CAS | 7424-91-1 |
| Molecular Weight (g/mol) | 148.158 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |
Methyl 4-Cyanobenzoate 98.0+%, TCI America™
CAS: 1129-35-7 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00001823 InChI Key: KKZMIDYKRKGJHG-UHFFFAOYSA-N Synonym: 4-cyanobenzoic acid methyl ester,benzoic acid, 4-cyano-, methyl ester,methyl p-cyanobenzoate,unii-f8fms7o8xg,f8fms7o8xg,benzoic acid, p-cyano-, methyl ester,4-cyano-benzoic acid methyl ester,methyl4-cyanobenzoate,methyl-4-cyanobenzoate,acmc-1bs5i PubChem CID: 70791 IUPAC Name: methyl 4-cyanobenzoate SMILES: COC(=O)C1=CC=C(C=C1)C#N
| PubChem CID | 70791 |
|---|---|
| CAS | 1129-35-7 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD00001823 |
| SMILES | COC(=O)C1=CC=C(C=C1)C#N |
| Synonym | 4-cyanobenzoic acid methyl ester,benzoic acid, 4-cyano-, methyl ester,methyl p-cyanobenzoate,unii-f8fms7o8xg,f8fms7o8xg,benzoic acid, p-cyano-, methyl ester,4-cyano-benzoic acid methyl ester,methyl4-cyanobenzoate,methyl-4-cyanobenzoate,acmc-1bs5i |
| IUPAC Name | methyl 4-cyanobenzoate |
| InChI Key | KKZMIDYKRKGJHG-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
Dimethyl cis-4-Cyclohexene-1,2-dicarboxylate 97.0+%, TCI America™
CAS: 4841-84-3 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00209581 InChI Key: DVVAGRMJGUQHLI-OCAPTIKFSA-N Synonym: dimethyl cis-4-cyclohexene-1,2-dicarboxylate,dimethyl cis-1,2,3,6-tetrahydrophthalate,cis-dimethyl cyclohex-4-ene-1,2-dicarboxylate,dimethylcis-4-cyclohexene-1,2-dicarboxylate,1r, 6s-methyl 6-methoxycarbonyl-3-cyclohexenecarboxylate,4-cyclohexene-1alpha,2alpha-dicarboxylic acid dimethyl ester,1,2-dimethyl 1r,2s-cyclohex-4-ene-1,2-dicarboxylate,4-cyclohexene-1,2-dicarboxylicacid, dimethyl ester, 1r,2s-rel PubChem CID: 10867283 IUPAC Name: dimethyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate SMILES: COC(=O)C1CC=CCC1C(=O)OC
| PubChem CID | 10867283 |
|---|---|
| CAS | 4841-84-3 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00209581 |
| SMILES | COC(=O)C1CC=CCC1C(=O)OC |
| Synonym | dimethyl cis-4-cyclohexene-1,2-dicarboxylate,dimethyl cis-1,2,3,6-tetrahydrophthalate,cis-dimethyl cyclohex-4-ene-1,2-dicarboxylate,dimethylcis-4-cyclohexene-1,2-dicarboxylate,1r, 6s-methyl 6-methoxycarbonyl-3-cyclohexenecarboxylate,4-cyclohexene-1alpha,2alpha-dicarboxylic acid dimethyl ester,1,2-dimethyl 1r,2s-cyclohex-4-ene-1,2-dicarboxylate,4-cyclohexene-1,2-dicarboxylicacid, dimethyl ester, 1r,2s-rel |
| IUPAC Name | dimethyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate |
| InChI Key | DVVAGRMJGUQHLI-OCAPTIKFSA-N |
| Molecular Formula | C10H14O4 |
Ethyl 2-Butynoate 98.0+%, TCI America™
CAS: 4341-76-8 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00015182 InChI Key: FCJJZKCJURDYNF-UHFFFAOYSA-N Synonym: ethyl 2-butynoate,ethyl tetrolate,2-butynoic acid ethyl ester,but-2-ynoic acid ethyl ester,2-butynoic acid, ethyl ester,tetrolic acid ethyl ester,ethyl-2-butynoate,ethyl 3-methylpropiolate,acmc-1aeo2,ethyl 1-propynecarboxylate PubChem CID: 78043 IUPAC Name: ethyl but-2-ynoate SMILES: CCOC(=O)C#CC
| PubChem CID | 78043 |
|---|---|
| CAS | 4341-76-8 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD00015182 |
| SMILES | CCOC(=O)C#CC |
| Synonym | ethyl 2-butynoate,ethyl tetrolate,2-butynoic acid ethyl ester,but-2-ynoic acid ethyl ester,2-butynoic acid, ethyl ester,tetrolic acid ethyl ester,ethyl-2-butynoate,ethyl 3-methylpropiolate,acmc-1aeo2,ethyl 1-propynecarboxylate |
| IUPAC Name | ethyl but-2-ynoate |
| InChI Key | FCJJZKCJURDYNF-UHFFFAOYSA-N |
| Molecular Formula | C6H8O2 |
Butyl 4-[(4-Methoxybenzylidene)amino]cinnamate 98.0+%, TCI America™
CAS: 16833-17-3 Molecular Formula: C21H23NO3 Molecular Weight (g/mol): 337.419 MDL Number: MFCD00059871 InChI Key: CULYZFOOJBHBNM-CIZPVDQASA-N Synonym: 4-(p-Anisalamino)cinnamic Acid Butyl Ester, 4-[(p-Anisylidene)amino]cinnamic Acid Butyl Ester, Butyl 4-(p-Anisalamino)cinnamate, Butyl 4-[(p-Anisylidene)amino]cinnamate, 4-[(4-Methoxybenzylidene)amino]cinnamic Acid Butyl Ester PubChem CID: 5705753 IUPAC Name: butyl (E)-3-[4-[(4-methoxyphenyl)methylideneamino]phenyl]prop-2-enoate SMILES: CCCCOC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC
| PubChem CID | 5705753 |
|---|---|
| CAS | 16833-17-3 |
| Molecular Weight (g/mol) | 337.419 |
| MDL Number | MFCD00059871 |
| SMILES | CCCCOC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC |
| Synonym | 4-(p-Anisalamino)cinnamic Acid Butyl Ester, 4-[(p-Anisylidene)amino]cinnamic Acid Butyl Ester, Butyl 4-(p-Anisalamino)cinnamate, Butyl 4-[(p-Anisylidene)amino]cinnamate, 4-[(4-Methoxybenzylidene)amino]cinnamic Acid Butyl Ester |
| IUPAC Name | butyl (E)-3-[4-[(4-methoxyphenyl)methylideneamino]phenyl]prop-2-enoate |
| InChI Key | CULYZFOOJBHBNM-CIZPVDQASA-N |
| Molecular Formula | C21H23NO3 |
Methyl 3-Bromopropionate 99.0+%, TCI America™
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 |
|---|---|
| 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 |
N-(9-Dimethylamino-1-oxononyl)-N-hydroxy-beta-alanine Methyl Ester 97.0+%, TCI America™
CAS: 1239468-48-4 Molecular Formula: C15H30N2O4 Molecular Weight (g/mol): 302.42 MDL Number: MFCD22375684 InChI Key: KDYRPQNFCURCQB-UHFFFAOYSA-N Synonym: NCDM-32b PubChem CID: 46901417 IUPAC Name: methyl 3-[9-(dimethylamino)-N-hydroxynonanamido]propanoate SMILES: COC(=O)CCN(O)C(=O)CCCCCCCCN(C)C
| PubChem CID | 46901417 |
|---|---|
| CAS | 1239468-48-4 |
| Molecular Weight (g/mol) | 302.42 |
| MDL Number | MFCD22375684 |
| SMILES | COC(=O)CCN(O)C(=O)CCCCCCCCN(C)C |
| Synonym | NCDM-32b |
| IUPAC Name | methyl 3-[9-(dimethylamino)-N-hydroxynonanamido]propanoate |
| InChI Key | KDYRPQNFCURCQB-UHFFFAOYSA-N |
| Molecular Formula | C15H30N2O4 |
Dimethyl Citraconate 99.0+%, TCI America™
CAS: 617-54-9 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00059306 InChI Key: WQEXBUQDXKPVHR-SNAWJCMRSA-N Synonym: Citraconic Acid Dimethyl Ester PubChem CID: 5355715 IUPAC Name: 1,4-dimethyl (2E)-2-methylbut-2-enedioate SMILES: COC(=O)\C=C(/C)C(=O)OC
| PubChem CID | 5355715 |
|---|---|
| CAS | 617-54-9 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00059306 |
| SMILES | COC(=O)\C=C(/C)C(=O)OC |
| Synonym | Citraconic Acid Dimethyl Ester |
| IUPAC Name | 1,4-dimethyl (2E)-2-methylbut-2-enedioate |
| InChI Key | WQEXBUQDXKPVHR-SNAWJCMRSA-N |
| Molecular Formula | C7H10O4 |
gamma-Crotonolactone 93.0+%, TCI America™
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: 2,5-dihydrofuran-2-one SMILES: O=C1OCC=C1
| PubChem CID | 10341 |
|---|---|
| CAS | 497-23-4 |
| Molecular Weight (g/mol) | 84.07 |
| ChEBI | CHEBI:38118 |
| MDL Number | MFCD00005376 |
| SMILES | O=C1OCC=C1 |
| 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 |
| IUPAC Name | 2,5-dihydrofuran-2-one |
| InChI Key | VIHAEDVKXSOUAT-UHFFFAOYSA-N |
| Molecular Formula | C4H4O2 |
Vinyl Laurate (stabilized with MEHQ) 99.0+%, TCI America™
CAS: 2146-71-6 Molecular Formula: C14H26O2 Molecular Weight (g/mol): 226.36 MDL Number: MFCD00048421 InChI Key: GLVVKKSPKXTQRB-UHFFFAOYSA-N Synonym: vinyl laurate,dodecanoic acid, ethenyl ester,vinyl dodecanoate,lauric acid, vinyl ester,lauric acid vinyl ester,lauric acid vinyl,acmc-209t6q,dodecanoic acid,ethenyl ester,lauric acid, vinyl ester 8ci,vinyl laurate gc PubChem CID: 75069 IUPAC Name: ethenyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OC=C
| PubChem CID | 75069 |
|---|---|
| CAS | 2146-71-6 |
| Molecular Weight (g/mol) | 226.36 |
| MDL Number | MFCD00048421 |
| SMILES | CCCCCCCCCCCC(=O)OC=C |
| Synonym | vinyl laurate,dodecanoic acid, ethenyl ester,vinyl dodecanoate,lauric acid, vinyl ester,lauric acid vinyl ester,lauric acid vinyl,acmc-209t6q,dodecanoic acid,ethenyl ester,lauric acid, vinyl ester 8ci,vinyl laurate gc |
| IUPAC Name | ethenyl dodecanoate |
| InChI Key | GLVVKKSPKXTQRB-UHFFFAOYSA-N |
| Molecular Formula | C14H26O2 |
Potassium Isobutyrate 98.0+%, TCI America™
CAS: 19455-20-0 Molecular Formula: C4H7KO2 Molecular Weight (g/mol): 126.196 MDL Number: MFCD00058992 InChI Key: LBOHISOWGKIIKX-UHFFFAOYSA-M Synonym: Isobutyric Acid Potassium Salt PubChem CID: 23677462 IUPAC Name: potassium;2-methylpropanoate SMILES: CC(C)C(=O)[O-].[K+]
| PubChem CID | 23677462 |
|---|---|
| CAS | 19455-20-0 |
| Molecular Weight (g/mol) | 126.196 |
| MDL Number | MFCD00058992 |
| SMILES | CC(C)C(=O)[O-].[K+] |
| Synonym | Isobutyric Acid Potassium Salt |
| IUPAC Name | potassium;2-methylpropanoate |
| InChI Key | LBOHISOWGKIIKX-UHFFFAOYSA-M |
| Molecular Formula | C4H7KO2 |
Sodium Pyruvate 97.0+%, TCI America™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.044 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 PubChem CID: 23662274 ChEBI: CHEBI:50144 IUPAC Name: sodium;2-oxopropanoate SMILES: CC(=O)C(=O)[O-].[Na+]
| PubChem CID | 23662274 |
|---|---|
| CAS | 113-24-6 |
| Molecular Weight (g/mol) | 110.044 |
| ChEBI | CHEBI:50144 |
| MDL Number | MFCD00002586 |
| SMILES | CC(=O)C(=O)[O-].[Na+] |
| Synonym | sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 |
| IUPAC Name | sodium;2-oxopropanoate |
| InChI Key | DAEPDZWVDSPTHF-UHFFFAOYSA-M |
| Molecular Formula | C3H3NaO3 |
Sodium Pivalate Hydrate 98.0+%, TCI America™
CAS: 143174-36-1 Molecular Formula: C5H9NaO2 Molecular Weight (g/mol): 124.12 MDL Number: MFCD00150782 InChI Key: SJRDNQOIQZOVQD-UHFFFAOYSA-M Synonym: sodium trimethylacetate hydrate,sodium pivalate hydrate,sodium hydrate pivalate,propanoic acid, 2,2-dimethyl-, sodium salt, hydrate,acmc-20ajn9,sodiumtrimethylacetatehydrate,c5h9o2.na.h2o,trimethylacetic acid sodium salt hydrate,sodium 2,2-dimethylpropanoate-water 1/1/1 PubChem CID: 23666172 IUPAC Name: sodium 2,2-dimethylpropanoate SMILES: [Na+].CC(C)(C)C([O-])=O
| PubChem CID | 23666172 |
|---|---|
| CAS | 143174-36-1 |
| Molecular Weight (g/mol) | 124.12 |
| MDL Number | MFCD00150782 |
| SMILES | [Na+].CC(C)(C)C([O-])=O |
| Synonym | sodium trimethylacetate hydrate,sodium pivalate hydrate,sodium hydrate pivalate,propanoic acid, 2,2-dimethyl-, sodium salt, hydrate,acmc-20ajn9,sodiumtrimethylacetatehydrate,c5h9o2.na.h2o,trimethylacetic acid sodium salt hydrate,sodium 2,2-dimethylpropanoate-water 1/1/1 |
| IUPAC Name | sodium 2,2-dimethylpropanoate |
| InChI Key | SJRDNQOIQZOVQD-UHFFFAOYSA-M |
| Molecular Formula | C5H9NaO2 |