Carboxylic acids and derivatives
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2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl Fluoride 98.0+%, TCI America™
CAS: 3934-29-0 Molecular Formula: C14H19FO9 Molecular Weight (g/mol): 350.30 MDL Number: MFCD00792705 InChI Key: JJXATNWYELAACC-UHFFFAOYNA-N PubChem CID: 11142654 IUPAC Name: [3,4,5-tris(acetyloxy)-6-fluorooxan-2-yl]methyl acetate SMILES: CC(=O)OCC1OC(F)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
| PubChem CID | 11142654 |
|---|---|
| CAS | 3934-29-0 |
| Molecular Weight (g/mol) | 350.30 |
| MDL Number | MFCD00792705 |
| SMILES | CC(=O)OCC1OC(F)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
| IUPAC Name | [3,4,5-tris(acetyloxy)-6-fluorooxan-2-yl]methyl acetate |
| InChI Key | JJXATNWYELAACC-UHFFFAOYNA-N |
| Molecular Formula | C14H19FO9 |
Ethyl 4-Phenylbutyrate 98.0+%, TCI America™
CAS: 10031-93-3 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00026923 InChI Key: GGFNXKFGVQQNRV-UHFFFAOYSA-N Synonym: 4-Phenylbutyric Acid Ethyl Ester PubChem CID: 61452 IUPAC Name: ethyl 4-phenylbutanoate SMILES: CCOC(=O)CCCC1=CC=CC=C1
| PubChem CID | 61452 |
|---|---|
| CAS | 10031-93-3 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00026923 |
| SMILES | CCOC(=O)CCCC1=CC=CC=C1 |
| Synonym | 4-Phenylbutyric Acid Ethyl Ester |
| IUPAC Name | ethyl 4-phenylbutanoate |
| InChI Key | GGFNXKFGVQQNRV-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
(+)-Di-p-toluoyl-D-tartaric Acid 98.0+%, TCI America™
CAS: 32634-68-7 Molecular Formula: C20H18O8 Molecular Weight (g/mol): 386.36 MDL Number: MFCD00008552 InChI Key: CMIBUZBMZCBCAT-HOTGVXAUSA-N Synonym: di-p-toluoyl-d-tartaric acid,+-di-1,4-toluoyl-d-tartaric acid,2s,3s-2,3-bis 4-methylbenzoyl oxy succinic acid,unii-4480ma5qip,ditoluoyltartaric acid, +,+-dtta,butanedioic acid, 2,3-bis 4-methylbenzoyl oxy-, 2s,3s,2s,3s-2,3-bis 4-methylbenzoyl oxy butanedioic acid,--di-p-toluoyl-l-trataric acid PubChem CID: 263211 IUPAC Name: (2S,3S)-2,3-bis(4-methylbenzoyloxy)butanedioic acid SMILES: CC1=CC=C(C=C1)C(=O)O[C@@H]([C@H](OC(=O)C1=CC=C(C)C=C1)C(O)=O)C(O)=O
| PubChem CID | 263211 |
|---|---|
| CAS | 32634-68-7 |
| Molecular Weight (g/mol) | 386.36 |
| MDL Number | MFCD00008552 |
| SMILES | CC1=CC=C(C=C1)C(=O)O[C@@H]([C@H](OC(=O)C1=CC=C(C)C=C1)C(O)=O)C(O)=O |
| Synonym | di-p-toluoyl-d-tartaric acid,+-di-1,4-toluoyl-d-tartaric acid,2s,3s-2,3-bis 4-methylbenzoyl oxy succinic acid,unii-4480ma5qip,ditoluoyltartaric acid, +,+-dtta,butanedioic acid, 2,3-bis 4-methylbenzoyl oxy-, 2s,3s,2s,3s-2,3-bis 4-methylbenzoyl oxy butanedioic acid,--di-p-toluoyl-l-trataric acid |
| IUPAC Name | (2S,3S)-2,3-bis(4-methylbenzoyloxy)butanedioic acid |
| InChI Key | CMIBUZBMZCBCAT-HOTGVXAUSA-N |
| Molecular Formula | C20H18O8 |
Ethyl Phthalyl Ethyl Glycolate 95.0+%, TCI America™
CAS: 84-72-0 Molecular Formula: C14H16O6 Molecular Weight (g/mol): 280.28 MDL Number: MFCD00059377 InChI Key: PZBLUWVMZMXIKZ-UHFFFAOYSA-N Synonym: Ethoxycarbonylmethyl Ethyl Phthalate, Phthalic Acid Ethoxycarbonylmethyl Ethyl Ester PubChem CID: 6785 IUPAC Name: ethyl 2-[(2-ethoxy-2-oxoethoxy)carbonyl]benzoate SMILES: CCOC(=O)COC(=O)C1=CC=CC=C1C(=O)OCC
| PubChem CID | 6785 |
|---|---|
| CAS | 84-72-0 |
| Molecular Weight (g/mol) | 280.28 |
| MDL Number | MFCD00059377 |
| SMILES | CCOC(=O)COC(=O)C1=CC=CC=C1C(=O)OCC |
| Synonym | Ethoxycarbonylmethyl Ethyl Phthalate, Phthalic Acid Ethoxycarbonylmethyl Ethyl Ester |
| IUPAC Name | ethyl 2-[(2-ethoxy-2-oxoethoxy)carbonyl]benzoate |
| InChI Key | PZBLUWVMZMXIKZ-UHFFFAOYSA-N |
| Molecular Formula | C14H16O6 |
Methyl (S)-(-)-2-Chloropropionate 98.0+%, TCI America™
CAS: 73246-45-4 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.55 MDL Number: MFCD00062941 InChI Key: JLEJCNOTNLZCHQ-VKHMYHEASA-N Synonym: (S)-(-)-2-Chloropropionic Acid Methyl Ester PubChem CID: 135535 IUPAC Name: methyl (2S)-2-chloropropanoate SMILES: COC(=O)[C@H](C)Cl
| PubChem CID | 135535 |
|---|---|
| CAS | 73246-45-4 |
| Molecular Weight (g/mol) | 122.55 |
| MDL Number | MFCD00062941 |
| SMILES | COC(=O)[C@H](C)Cl |
| Synonym | (S)-(-)-2-Chloropropionic Acid Methyl Ester |
| IUPAC Name | methyl (2S)-2-chloropropanoate |
| InChI Key | JLEJCNOTNLZCHQ-VKHMYHEASA-N |
| Molecular Formula | C4H7ClO2 |
Hydroxypropyl Methacrylate (mixture of 2-Hydroxypropyl and 2-Hydroxy-1-methylethyl Methacrylate) 97.0+%, TCI America™
CAS: 27813-02-1 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00004536 InChI Key: ZMARGGQEAJXRFP-UHFFFAOYNA-N Synonym: 2-hydroxypropyl methacrylate,2-hydroxypropylmethacrylate,hpma,beta-hydroxypropyl methacrylate,acryester hp,2-hydroxypropyl 2-methylacrylate,poly 2-hydroxypropyl methacrylate,2-hydroxypropyl 2-methyl-2-propenoate,2-propenoic acid, 2-methyl-, 2-hydroxypropyl ester,2-hpma PubChem CID: 13539 ChEBI: CHEBI:53440 IUPAC Name: 1-hydroxypropan-2-yl 2-methylprop-2-enoate SMILES: CC(CO)OC(=O)C(C)=C
| PubChem CID | 13539 |
|---|---|
| CAS | 27813-02-1 |
| Molecular Weight (g/mol) | 144.17 |
| ChEBI | CHEBI:53440 |
| MDL Number | MFCD00004536 |
| SMILES | CC(CO)OC(=O)C(C)=C |
| Synonym | 2-hydroxypropyl methacrylate,2-hydroxypropylmethacrylate,hpma,beta-hydroxypropyl methacrylate,acryester hp,2-hydroxypropyl 2-methylacrylate,poly 2-hydroxypropyl methacrylate,2-hydroxypropyl 2-methyl-2-propenoate,2-propenoic acid, 2-methyl-, 2-hydroxypropyl ester,2-hpma |
| IUPAC Name | 1-hydroxypropan-2-yl 2-methylprop-2-enoate |
| InChI Key | ZMARGGQEAJXRFP-UHFFFAOYNA-N |
| Molecular Formula | C7H12O3 |
Pyrrole-2-carboxylic Acid 98.0+%, TCI America™
CAS: 634-97-9 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 MDL Number: MFCD00005219 InChI Key: WRHZVMBBRYBTKZ-UHFFFAOYSA-N Synonym: pyrrole-2-carboxylic acid,minaline,minalin,2-pyrrolecarboxylic acid,pyrrole-2-carboxylicacid,pyrrole-2-carboxylate,2-carboxypyrrole,1h-pyrrolecarboxylic acid,9ci,pyc PubChem CID: 12473 ChEBI: CHEBI:36751 IUPAC Name: 1H-pyrrole-2-carboxylic acid SMILES: C1=CNC(=C1)C(=O)O
| PubChem CID | 12473 |
|---|---|
| CAS | 634-97-9 |
| Molecular Weight (g/mol) | 111.1 |
| ChEBI | CHEBI:36751 |
| MDL Number | MFCD00005219 |
| SMILES | C1=CNC(=C1)C(=O)O |
| Synonym | pyrrole-2-carboxylic acid,minaline,minalin,2-pyrrolecarboxylic acid,pyrrole-2-carboxylicacid,pyrrole-2-carboxylate,2-carboxypyrrole,1h-pyrrolecarboxylic acid,9ci,pyc |
| IUPAC Name | 1H-pyrrole-2-carboxylic acid |
| InChI Key | WRHZVMBBRYBTKZ-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2 |
3-Methylvaleric Acid 98.0+%, TCI America™
CAS: 105-43-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002729,MFCD02262177 InChI Key: IGIDLTISMCAULB-UHFFFAOYNA-N Synonym: 3-methylvaleric acid,3-methyl-pentanoic acid,pentanoic acid, 3-methyl,3-methyl valeric acid,dl-3-methylvaleric acid,3-methyl pentanoic acid,sec-butylacetic acid,valeric acid, 3-methyl,beta-methylvaleric acid,3-methyl-n-valeric acid PubChem CID: 7755 IUPAC Name: 3-methylpentanoic acid SMILES: CCC(C)CC(O)=O
| PubChem CID | 7755 |
|---|---|
| CAS | 105-43-1 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00002729,MFCD02262177 |
| SMILES | CCC(C)CC(O)=O |
| Synonym | 3-methylvaleric acid,3-methyl-pentanoic acid,pentanoic acid, 3-methyl,3-methyl valeric acid,dl-3-methylvaleric acid,3-methyl pentanoic acid,sec-butylacetic acid,valeric acid, 3-methyl,beta-methylvaleric acid,3-methyl-n-valeric acid |
| IUPAC Name | 3-methylpentanoic acid |
| InChI Key | IGIDLTISMCAULB-UHFFFAOYNA-N |
| Molecular Formula | C6H12O2 |
N-Methyl-N-(2-pyridyl)formamide 98.0+%, TCI America™
CAS: 67242-59-5 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 MDL Number: MFCD00006260 InChI Key: DIRVEOCOAHGVJV-UHFFFAOYSA-N PubChem CID: 572611 IUPAC Name: N-methyl-N-pyridin-2-ylformamide SMILES: CN(C=O)C1=CC=CC=N1
| PubChem CID | 572611 |
|---|---|
| CAS | 67242-59-5 |
| Molecular Weight (g/mol) | 136.154 |
| MDL Number | MFCD00006260 |
| SMILES | CN(C=O)C1=CC=CC=N1 |
| IUPAC Name | N-methyl-N-pyridin-2-ylformamide |
| InChI Key | DIRVEOCOAHGVJV-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
Butyl Laurate 99.0+%, TCI America™
CAS: 106-18-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00042870 InChI Key: NDKYEUQMPZIGFN-UHFFFAOYSA-N Synonym: butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate PubChem CID: 61015 IUPAC Name: butyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCCCC
| PubChem CID | 61015 |
|---|---|
| CAS | 106-18-3 |
| Molecular Weight (g/mol) | 256.43 |
| MDL Number | MFCD00042870 |
| SMILES | CCCCCCCCCCCC(=O)OCCCC |
| Synonym | butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate |
| IUPAC Name | butyl dodecanoate |
| InChI Key | NDKYEUQMPZIGFN-UHFFFAOYSA-N |
| Molecular Formula | C16H32O2 |
3-Phenylpropionamide 98.0+%, TCI America™
CAS: 102-93-2 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 MDL Number: MFCD00025535 InChI Key: VYIBCOSBNVFEIW-UHFFFAOYSA-N PubChem CID: 7625 IUPAC Name: 3-phenylpropanamide SMILES: C1=CC=C(C=C1)CCC(=O)N
| PubChem CID | 7625 |
|---|---|
| CAS | 102-93-2 |
| Molecular Weight (g/mol) | 149.193 |
| MDL Number | MFCD00025535 |
| SMILES | C1=CC=C(C=C1)CCC(=O)N |
| IUPAC Name | 3-phenylpropanamide |
| InChI Key | VYIBCOSBNVFEIW-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
2'-Bromo-4'-fluoroacetanilide 98.0+%, TCI America™
CAS: 1009-22-9 Molecular Formula: C8H7BrFNO Molecular Weight (g/mol): 232.05 MDL Number: MFCD00061118 InChI Key: JAVSBNOXENOHEI-UHFFFAOYSA-N Synonym: 2'-bromo-4'-fluoroacetanilide,n-2-bromo-4-fluorophenyl acetamide,2-bromo-4-fluoroacetanilide,n-acetyl 2-bromo-4-fluoroaniline,n-2-bromo-4-fluoro-phenyl acetamide,acetamide, n-2-bromo-4-fluorophenyl,maybridge3_000074,ksc180o6b,javsbnoxenohei-uhfffaoysa,n-acetyl2-bromo-4-fluoroaniline PubChem CID: 688184 IUPAC Name: N-(2-bromo-4-fluorophenyl)acetamide SMILES: CC(=O)NC1=CC=C(F)C=C1Br
| PubChem CID | 688184 |
|---|---|
| CAS | 1009-22-9 |
| Molecular Weight (g/mol) | 232.05 |
| MDL Number | MFCD00061118 |
| SMILES | CC(=O)NC1=CC=C(F)C=C1Br |
| Synonym | 2'-bromo-4'-fluoroacetanilide,n-2-bromo-4-fluorophenyl acetamide,2-bromo-4-fluoroacetanilide,n-acetyl 2-bromo-4-fluoroaniline,n-2-bromo-4-fluoro-phenyl acetamide,acetamide, n-2-bromo-4-fluorophenyl,maybridge3_000074,ksc180o6b,javsbnoxenohei-uhfffaoysa,n-acetyl2-bromo-4-fluoroaniline |
| IUPAC Name | N-(2-bromo-4-fluorophenyl)acetamide |
| InChI Key | JAVSBNOXENOHEI-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrFNO |
4'-Iodoacetanilide 95.0+%, TCI America™
CAS: 622-50-4 Molecular Formula: C8H8INO Molecular Weight (g/mol): 261.062 MDL Number: MFCD00016352 InChI Key: SIULLDWIXYYVCU-UHFFFAOYSA-N Synonym: n-4-iodophenyl acetamide,4-iodoacetanilide,4'-iodoacetanilide,p-iodoacetanilide,acetamide, n-4-iodophenyl,acetanilide, 4'-iodo,4'-iodo-acetanilide,pubchem3293,acmc-20akb8,maybridge1_006480 PubChem CID: 12147 IUPAC Name: N-(4-iodophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)I
| PubChem CID | 12147 |
|---|---|
| CAS | 622-50-4 |
| Molecular Weight (g/mol) | 261.062 |
| MDL Number | MFCD00016352 |
| SMILES | CC(=O)NC1=CC=C(C=C1)I |
| Synonym | n-4-iodophenyl acetamide,4-iodoacetanilide,4'-iodoacetanilide,p-iodoacetanilide,acetamide, n-4-iodophenyl,acetanilide, 4'-iodo,4'-iodo-acetanilide,pubchem3293,acmc-20akb8,maybridge1_006480 |
| IUPAC Name | N-(4-iodophenyl)acetamide |
| InChI Key | SIULLDWIXYYVCU-UHFFFAOYSA-N |
| Molecular Formula | C8H8INO |
Methyl Phenylpropiolate 98.0+%, TCI America™
CAS: 4891-38-7 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.172 MDL Number: MFCD00041685 InChI Key: JFGWPXKGINUNDH-UHFFFAOYSA-N Synonym: methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate PubChem CID: 138378 IUPAC Name: methyl 3-phenylprop-2-ynoate SMILES: COC(=O)C#CC1=CC=CC=C1
| PubChem CID | 138378 |
|---|---|
| CAS | 4891-38-7 |
| Molecular Weight (g/mol) | 160.172 |
| MDL Number | MFCD00041685 |
| SMILES | COC(=O)C#CC1=CC=CC=C1 |
| Synonym | methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate |
| IUPAC Name | methyl 3-phenylprop-2-ynoate |
| InChI Key | JFGWPXKGINUNDH-UHFFFAOYSA-N |
| Molecular Formula | C10H8O2 |
1-Methyl-2-pyrrolecarboxylic Acid 98.0+%, TCI America™
CAS: 6973-60-0 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD00003088 InChI Key: ILAOVOOZLVGAJF-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrrole-2-carboxylic acid,1-methyl-2-pyrrolecarboxylic acid,n-methylpyrrole-2-carboxylic acid,1h-pyrrole-2-carboxylic acid, 1-methyl,1h-pyrrolecarboxylic acid, methyl,1-methyl-1h-pyrrole-2-carboxylicacid,pubchem9181,acmc-209oar,ksc353i0t,2-carboxy-1-methyl-1h-pyrrole PubChem CID: 81453 IUPAC Name: 1-methylpyrrole-2-carboxylic acid SMILES: CN1C=CC=C1C(=O)O
| PubChem CID | 81453 |
|---|---|
| CAS | 6973-60-0 |
| Molecular Weight (g/mol) | 125.127 |
| MDL Number | MFCD00003088 |
| SMILES | CN1C=CC=C1C(=O)O |
| Synonym | 1-methyl-1h-pyrrole-2-carboxylic acid,1-methyl-2-pyrrolecarboxylic acid,n-methylpyrrole-2-carboxylic acid,1h-pyrrole-2-carboxylic acid, 1-methyl,1h-pyrrolecarboxylic acid, methyl,1-methyl-1h-pyrrole-2-carboxylicacid,pubchem9181,acmc-209oar,ksc353i0t,2-carboxy-1-methyl-1h-pyrrole |
| IUPAC Name | 1-methylpyrrole-2-carboxylic acid |
| InChI Key | ILAOVOOZLVGAJF-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |