Carboxylic acids and derivatives
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1-Formylpiperazine, tech. 90
CAS: 7755-92-2 Molecular Formula: C5H11N2O Molecular Weight (g/mol): 115.16 MDL Number: MFCD00005963 InChI Key: MSSDTZLYNMFTKN-UHFFFAOYSA-O Synonym: 1-formylpiperazine,1-piperazinecarboxaldehyde,1-piperazinecarbaldehyde,formylpiperazine,n-formylpiperazine,1-formyl piperazine,piperazinecarbaldehyde,l-formylpiperazine,4-formylpiperazine,n-formyl piperazine PubChem CID: 82191 IUPAC Name: piperazine-1-carbaldehyde SMILES: O=CN1CC[NH2+]CC1
| PubChem CID | 82191 |
|---|---|
| CAS | 7755-92-2 |
| Molecular Weight (g/mol) | 115.16 |
| MDL Number | MFCD00005963 |
| SMILES | O=CN1CC[NH2+]CC1 |
| Synonym | 1-formylpiperazine,1-piperazinecarboxaldehyde,1-piperazinecarbaldehyde,formylpiperazine,n-formylpiperazine,1-formyl piperazine,piperazinecarbaldehyde,l-formylpiperazine,4-formylpiperazine,n-formyl piperazine |
| IUPAC Name | piperazine-1-carbaldehyde |
| InChI Key | MSSDTZLYNMFTKN-UHFFFAOYSA-O |
| Molecular Formula | C5H11N2O |
Methyl 3-methoxyphenylacetate, 97%
CAS: 18927-05-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00017205 InChI Key: BSVIOYCZTJRBDB-UHFFFAOYSA-N Synonym: methyl 2-3-methoxyphenyl acetate,methyl 3-methoxyphenylacetate,benzeneacetic acid, 3-methoxy-, methyl ester,acetic acid, m-methoxyphenyl-, methyl ester,methyl 3-methoxyphenyl acetate,3-methoxy-phenyl-acetic acid methyl ester,acmc-1brer,methyl m-methoxyphenylacetate,methyl 3-methoxy-phenylacetate PubChem CID: 519609 IUPAC Name: methyl 2-(3-methoxyphenyl)acetate SMILES: COC1=CC=CC(=C1)CC(=O)OC
| PubChem CID | 519609 |
|---|---|
| CAS | 18927-05-4 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00017205 |
| SMILES | COC1=CC=CC(=C1)CC(=O)OC |
| Synonym | methyl 2-3-methoxyphenyl acetate,methyl 3-methoxyphenylacetate,benzeneacetic acid, 3-methoxy-, methyl ester,acetic acid, m-methoxyphenyl-, methyl ester,methyl 3-methoxyphenyl acetate,3-methoxy-phenyl-acetic acid methyl ester,acmc-1brer,methyl m-methoxyphenylacetate,methyl 3-methoxy-phenylacetate |
| IUPAC Name | methyl 2-(3-methoxyphenyl)acetate |
| InChI Key | BSVIOYCZTJRBDB-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Mono-methyl phthalate, 98%
CAS: 4376-18-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002466 InChI Key: FNJSWIPFHMKRAT-UHFFFAOYSA-N Synonym: 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr PubChem CID: 20392 IUPAC Name: 2-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=CC=C1C(O)=O
| PubChem CID | 20392 |
|---|---|
| CAS | 4376-18-5 |
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00002466 |
| SMILES | COC(=O)C1=CC=CC=C1C(O)=O |
| Synonym | 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr |
| IUPAC Name | 2-methoxycarbonylbenzoic acid |
| InChI Key | FNJSWIPFHMKRAT-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
(3S)-(-)-3-Acetamidopyrrolidine, 98%
CAS: 114636-31-6 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.18 MDL Number: MFCD00082748 InChI Key: HDCCJUCOIKLZNM-UHFFFAOYNA-N Synonym: 3s---3-acetamidopyrrolidine,s-n-pyrrolidin-3-yl acetamide,n-3s-pyrrolidin-3-yl acetamide,s-3-acetamidopyrrolidine,acetamide, n-3s-3-pyrrolidinyl,n-3-pyrrolidinyl acetamide #,+-n-3r-pyrrolidin-3-yl acetamide,s-3-acetamido-pyrrolidine,3s-3-acetamidopyrrolidine,s-n-pyrrolidin-3-ylacetamide PubChem CID: 7021471 IUPAC Name: N-[(3S)-pyrrolidin-3-yl]acetamide SMILES: CC(=O)NC1CCNC1
| PubChem CID | 7021471 |
|---|---|
| CAS | 114636-31-6 |
| Molecular Weight (g/mol) | 128.18 |
| MDL Number | MFCD00082748 |
| SMILES | CC(=O)NC1CCNC1 |
| Synonym | 3s---3-acetamidopyrrolidine,s-n-pyrrolidin-3-yl acetamide,n-3s-pyrrolidin-3-yl acetamide,s-3-acetamidopyrrolidine,acetamide, n-3s-3-pyrrolidinyl,n-3-pyrrolidinyl acetamide #,+-n-3r-pyrrolidin-3-yl acetamide,s-3-acetamido-pyrrolidine,3s-3-acetamidopyrrolidine,s-n-pyrrolidin-3-ylacetamide |
| IUPAC Name | N-[(3S)-pyrrolidin-3-yl]acetamide |
| InChI Key | HDCCJUCOIKLZNM-UHFFFAOYNA-N |
| Molecular Formula | C6H12N2O |
N-Vinylformamide (Stabilized with BHT), 96+ Percent, Spectrum™ Chemical
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CAS: 13162-05-5
| CAS | 13162-05-5 |
|---|
1,3,5-Tri(4-carboxyphenyl)benzene, 97%
CAS: 50446-44-1 Molecular Formula: C27H18O6 Molecular Weight (g/mol): 438.44 MDL Number: MFCD10000888 InChI Key: SATWKVZGMWCXOJ-UHFFFAOYSA-N Synonym: 1,3,5-tris 4-carboxyphenyl benzene,1,3,5-tri 4-carboxyphenyl benzene,5'-4-carboxyphenyl-1,1':3',1-terphenyl-4,4-dicarboxylic acid,1,1':3',1-terphenyl-4,4-dicarboxylic acid, 5'-4-carboxyphenyl,acmc-209kmn,h3btb,4,4?,4??,-benzene-1,3,5-triyl-tris benzoic acid,1,3,5-tris 4-carboxyphenyl benzene, ≤20 wt. % solvent,3',5'-bis 4-carboxyphenyl-1,1'-biphenyl-4-carboxylic acid,5'-4-carboxyphenyl-1,1':3',1-terphenyl-4,4-dicarboxylicacid PubChem CID: 10694305 IUPAC Name: 4-[3,5-bis(4-carboxyphenyl)phenyl]benzoic acid SMILES: OC(=O)C1=CC=C(C=C1)C1=CC(=CC(=C1)C1=CC=C(C=C1)C(O)=O)C1=CC=C(C=C1)C(O)=O
| PubChem CID | 10694305 |
|---|---|
| CAS | 50446-44-1 |
| Molecular Weight (g/mol) | 438.44 |
| MDL Number | MFCD10000888 |
| SMILES | OC(=O)C1=CC=C(C=C1)C1=CC(=CC(=C1)C1=CC=C(C=C1)C(O)=O)C1=CC=C(C=C1)C(O)=O |
| Synonym | 1,3,5-tris 4-carboxyphenyl benzene,1,3,5-tri 4-carboxyphenyl benzene,5'-4-carboxyphenyl-1,1':3',1-terphenyl-4,4-dicarboxylic acid,1,1':3',1-terphenyl-4,4-dicarboxylic acid, 5'-4-carboxyphenyl,acmc-209kmn,h3btb,4,4?,4??,-benzene-1,3,5-triyl-tris benzoic acid,1,3,5-tris 4-carboxyphenyl benzene, ≤20 wt. % solvent,3',5'-bis 4-carboxyphenyl-1,1'-biphenyl-4-carboxylic acid,5'-4-carboxyphenyl-1,1':3',1-terphenyl-4,4-dicarboxylicacid |
| IUPAC Name | 4-[3,5-bis(4-carboxyphenyl)phenyl]benzoic acid |
| InChI Key | SATWKVZGMWCXOJ-UHFFFAOYSA-N |
| Molecular Formula | C27H18O6 |
7-Fluorooxindole, 95%
CAS: 71294-03-6 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD02179608 InChI Key: VMUIOEOYZHJLEZ-UHFFFAOYSA-N Synonym: 7-fluorooxindole,7-fluoroindolin-2-one,7-fluoro-oxindole,7-fluoro-2-oxindole,7-fluoroindolinone,7-fluoro-1,3-dihydro-2h-indol-2-one,2h-indol-2-one, 7-fluoro-1,3-dihydro,7-fluoro-1,3-dihydro-indol-2-one,7-fluoro-2,3-dihydro-1h-indol-2-one,1,3-dihydro-7-fluoro-2h-indol-2-one PubChem CID: 3734371 IUPAC Name: 7-fluoro-1,3-dihydroindol-2-one SMILES: C1C2=C(C(=CC=C2)F)NC1=O
| PubChem CID | 3734371 |
|---|---|
| CAS | 71294-03-6 |
| Molecular Weight (g/mol) | 151.14 |
| MDL Number | MFCD02179608 |
| SMILES | C1C2=C(C(=CC=C2)F)NC1=O |
| Synonym | 7-fluorooxindole,7-fluoroindolin-2-one,7-fluoro-oxindole,7-fluoro-2-oxindole,7-fluoroindolinone,7-fluoro-1,3-dihydro-2h-indol-2-one,2h-indol-2-one, 7-fluoro-1,3-dihydro,7-fluoro-1,3-dihydro-indol-2-one,7-fluoro-2,3-dihydro-1h-indol-2-one,1,3-dihydro-7-fluoro-2h-indol-2-one |
| IUPAC Name | 7-fluoro-1,3-dihydroindol-2-one |
| InChI Key | VMUIOEOYZHJLEZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6FNO |
trans-4-Methylcyclohexanecarboxylic acid, 98%
CAS: 13064-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00074943,MFCD00074909,MFCD20617670 InChI Key: QTDXSEZXAPHVBI-UHFFFAOYSA-N Synonym: trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv PubChem CID: 20330 IUPAC Name: 4-methylcyclohexane-1-carboxylic acid SMILES: CC1CCC(CC1)C(O)=O
| PubChem CID | 20330 |
|---|---|
| CAS | 13064-83-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00074943,MFCD00074909,MFCD20617670 |
| SMILES | CC1CCC(CC1)C(O)=O |
| Synonym | trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv |
| IUPAC Name | 4-methylcyclohexane-1-carboxylic acid |
| InChI Key | QTDXSEZXAPHVBI-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Isobutyl acetate, 98%
CAS: 110-19-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008932 InChI Key: GJRQTCIYDGXPES-UHFFFAOYSA-N Synonym: isobutyl acetate,isobutyl ethanoate,acetic acid, 2-methylpropyl ester,2-methyl-1-propyl acetate,2-methylpropyl ethanoate,acetic acid, isobutyl ester,acetic acid isobutyl ester,acetate d'isobutyle,iso-butyl acetate,beta-methylpropyl ethanoate PubChem CID: 8038 ChEBI: CHEBI:50569 IUPAC Name: 2-methylpropyl acetate SMILES: CC(C)COC(C)=O
| PubChem CID | 8038 |
|---|---|
| CAS | 110-19-0 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:50569 |
| MDL Number | MFCD00008932 |
| SMILES | CC(C)COC(C)=O |
| Synonym | isobutyl acetate,isobutyl ethanoate,acetic acid, 2-methylpropyl ester,2-methyl-1-propyl acetate,2-methylpropyl ethanoate,acetic acid, isobutyl ester,acetic acid isobutyl ester,acetate d'isobutyle,iso-butyl acetate,beta-methylpropyl ethanoate |
| IUPAC Name | 2-methylpropyl acetate |
| InChI Key | GJRQTCIYDGXPES-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
1,3-Dibromo-5,5-dimethylhydantoin, 98%
CAS: 77-48-5 Molecular Formula: C5H6Br2N2O2 Molecular Weight (g/mol): 285.923 MDL Number: MFCD00003189 InChI Key: VRLDVERQJMEPIF-UHFFFAOYSA-N Synonym: 1,3-dibromo-5,5-dimethylhydantoin,dibromantin,dibromantine,take charge orange,dbdmh,n,n'-dibromodimethylhydantoin,5,5-dimethyl-1,3-dibromohydantoin,2,4-imidazolidinedione, 1,3-dibromo-5,5-dimethyl,1,3-dibromo-5,5-dimethyl-2,4-imidazolidinedione,unii-v9r5f9i7mz PubChem CID: 6479 IUPAC Name: 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione SMILES: CC1(C(=O)N(C(=O)N1Br)Br)C
| PubChem CID | 6479 |
|---|---|
| CAS | 77-48-5 |
| Molecular Weight (g/mol) | 285.923 |
| MDL Number | MFCD00003189 |
| SMILES | CC1(C(=O)N(C(=O)N1Br)Br)C |
| Synonym | 1,3-dibromo-5,5-dimethylhydantoin,dibromantin,dibromantine,take charge orange,dbdmh,n,n'-dibromodimethylhydantoin,5,5-dimethyl-1,3-dibromohydantoin,2,4-imidazolidinedione, 1,3-dibromo-5,5-dimethyl,1,3-dibromo-5,5-dimethyl-2,4-imidazolidinedione,unii-v9r5f9i7mz |
| IUPAC Name | 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione |
| InChI Key | VRLDVERQJMEPIF-UHFFFAOYSA-N |
| Molecular Formula | C5H6Br2N2O2 |
Sodium pyruvate, MP Biomedicals™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.04 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: Pyruvic acid sodium salt,2-Oxopropanoic acid sodium salt,α-ketopropionic acid sodium salt
| CAS | 113-24-6 |
|---|---|
| Molecular Weight (g/mol) | 110.04 |
| MDL Number | MFCD00002586 |
| Synonym | Pyruvic acid sodium salt,2-Oxopropanoic acid sodium salt,α-ketopropionic acid sodium salt |
| InChI Key | DAEPDZWVDSPTHF-UHFFFAOYSA-M |
| Molecular Formula | C3H3NaO3 |
4-(Acetamidomethyl)benzeneboronic acid, 97%
CAS: 850568-41-1 Molecular Formula: C9H12BNO3 Molecular Weight (g/mol): 193.009 MDL Number: MFCD06659818 InChI Key: ZMJVNKSOLIUBKO-UHFFFAOYSA-N Synonym: 4-acetamidomethyl phenyl boronic acid,4-acetamidomethylphenylboronic acid,4-acetamidomethylphenyl boronic acid,4-acetamidomethyl benzeneboronic acid,4-acetylaminomethyl benzeneboronic acid,4-acetamidomethyl phenylboronic acid,boronic acid,b-4-acetylamino methyl phenyl,4-acetamidomethylbenzeneboronic acid,pubchem14580 PubChem CID: 22309454 IUPAC Name: [4-(acetamidomethyl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)CNC(=O)C)(O)O
| PubChem CID | 22309454 |
|---|---|
| CAS | 850568-41-1 |
| Molecular Weight (g/mol) | 193.009 |
| MDL Number | MFCD06659818 |
| SMILES | B(C1=CC=C(C=C1)CNC(=O)C)(O)O |
| Synonym | 4-acetamidomethyl phenyl boronic acid,4-acetamidomethylphenylboronic acid,4-acetamidomethylphenyl boronic acid,4-acetamidomethyl benzeneboronic acid,4-acetylaminomethyl benzeneboronic acid,4-acetamidomethyl phenylboronic acid,boronic acid,b-4-acetylamino methyl phenyl,4-acetamidomethylbenzeneboronic acid,pubchem14580 |
| IUPAC Name | [4-(acetamidomethyl)phenyl]boronic acid |
| InChI Key | ZMJVNKSOLIUBKO-UHFFFAOYSA-N |
| Molecular Formula | C9H12BNO3 |
Ethyl 2,4-dioxo-5-methylhexanoate, 95%
CAS: 64195-85-3 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.21 MDL Number: MFCD07323638 InChI Key: HBJPUWYQVWIKSD-UHFFFAOYSA-N Synonym: ethyl5-methyl-2,4-dioxohexanoate,ethyl 2,4-dioxo-5-methylhexanoate,5-methyl-2,4-dioxohexanoic acid ethyl ester,hexanoic acid,5-methyl-2,4-dioxo-, ethyl ester,5-methyl-2,4-dioxo-hexanoic acid ethyl ester,acmc-1bc7v,ethyl-2,4-dioxo-5-methylhexanoate,ethyl 5-methyl-2,4-dioxo-hexanoate,ethyl 5-methyl-2,4-bis oxidanylidene hexanoate PubChem CID: 3017501 IUPAC Name: ethyl 5-methyl-2,4-dioxohexanoate SMILES: CCOC(=O)C(=O)CC(=O)C(C)C
| PubChem CID | 3017501 |
|---|---|
| CAS | 64195-85-3 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD07323638 |
| SMILES | CCOC(=O)C(=O)CC(=O)C(C)C |
| Synonym | ethyl5-methyl-2,4-dioxohexanoate,ethyl 2,4-dioxo-5-methylhexanoate,5-methyl-2,4-dioxohexanoic acid ethyl ester,hexanoic acid,5-methyl-2,4-dioxo-, ethyl ester,5-methyl-2,4-dioxo-hexanoic acid ethyl ester,acmc-1bc7v,ethyl-2,4-dioxo-5-methylhexanoate,ethyl 5-methyl-2,4-dioxo-hexanoate,ethyl 5-methyl-2,4-bis oxidanylidene hexanoate |
| IUPAC Name | ethyl 5-methyl-2,4-dioxohexanoate |
| InChI Key | HBJPUWYQVWIKSD-UHFFFAOYSA-N |
| Molecular Formula | C9H14O4 |
Dicyclohexylacetic acid, 98+%
CAS: 52034-92-1 Molecular Formula: C14H24O2 Molecular Weight (g/mol): 224.344 MDL Number: MFCD00075017 InChI Key: PGGMEZOUAPIYOY-UHFFFAOYSA-N Synonym: dicyclohexylacetic acid,hexahydro-diphenylessig,dicyclohexyl acetic acid,dicyclohexyl-acetic acid,acmc-20ala4 PubChem CID: 3661562 IUPAC Name: 2,2-dicyclohexylacetic acid SMILES: C1CCC(CC1)C(C2CCCCC2)C(=O)O
| PubChem CID | 3661562 |
|---|---|
| CAS | 52034-92-1 |
| Molecular Weight (g/mol) | 224.344 |
| MDL Number | MFCD00075017 |
| SMILES | C1CCC(CC1)C(C2CCCCC2)C(=O)O |
| Synonym | dicyclohexylacetic acid,hexahydro-diphenylessig,dicyclohexyl acetic acid,dicyclohexyl-acetic acid,acmc-20ala4 |
| IUPAC Name | 2,2-dicyclohexylacetic acid |
| InChI Key | PGGMEZOUAPIYOY-UHFFFAOYSA-N |
| Molecular Formula | C14H24O2 |
| CAS | 6097-08-1 |
|---|---|
| MDL Number | MFCD00671372 |