Organic acids and derivatives
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DL-Lactic Acid 85.0+%, TCI America™
CAS: 50-21-5 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.08 MDL Number: MFCD00004520 InChI Key: JVTAAEKCZFNVCJ-UHFFFAOYNA-N Synonym: lactic acid,dl-lactic acid,2-hydroxypropionic acid,milk acid,lactate,polylactic acid,ethylidenelactic acid,lactovagan,tonsillosan,acidum lacticum PubChem CID: 612 ChEBI: CHEBI:78320 IUPAC Name: 2-hydroxypropanoic acid SMILES: CC(O)C(O)=O
| PubChem CID | 612 |
|---|---|
| CAS | 50-21-5 |
| Molecular Weight (g/mol) | 90.08 |
| ChEBI | CHEBI:78320 |
| MDL Number | MFCD00004520 |
| SMILES | CC(O)C(O)=O |
| Synonym | lactic acid,dl-lactic acid,2-hydroxypropionic acid,milk acid,lactate,polylactic acid,ethylidenelactic acid,lactovagan,tonsillosan,acidum lacticum |
| IUPAC Name | 2-hydroxypropanoic acid |
| InChI Key | JVTAAEKCZFNVCJ-UHFFFAOYNA-N |
| Molecular Formula | C3H6O3 |
m-Tolylacetic Acid 98.0+%, TCI America™
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 |
|---|---|
| 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 |
Ethyl Palmitate 97.0+%, TCI America™
CAS: 628-97-7 Molecular Formula: C18H36O2 Molecular Weight (g/mol): 284.48 MDL Number: MFCD00008996 InChI Key: XIRNKXNNONJFQO-UHFFFAOYSA-N Synonym: ethyl palmitate,hexadecanoic acid, ethyl ester,palmitic acid ethyl ester,ethyl cetylate,palmitic acid, ethyl ester,ethylpalmitate,unii-ird3m534zm,hexadecanoic acid ethyl ester,ethyl n-hexadecanoate,ird3m534zm PubChem CID: 12366 ChEBI: CHEBI:84932 IUPAC Name: ethyl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OCC
| PubChem CID | 12366 |
|---|---|
| CAS | 628-97-7 |
| Molecular Weight (g/mol) | 284.48 |
| ChEBI | CHEBI:84932 |
| MDL Number | MFCD00008996 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC |
| Synonym | ethyl palmitate,hexadecanoic acid, ethyl ester,palmitic acid ethyl ester,ethyl cetylate,palmitic acid, ethyl ester,ethylpalmitate,unii-ird3m534zm,hexadecanoic acid ethyl ester,ethyl n-hexadecanoate,ird3m534zm |
| IUPAC Name | ethyl hexadecanoate |
| InChI Key | XIRNKXNNONJFQO-UHFFFAOYSA-N |
| Molecular Formula | C18H36O2 |
3-(Dodecylthio)propionic Acid 90.0+%, TCI America™
CAS: 1462-52-8 Molecular Formula: C15H30O2S Molecular Weight (g/mol): 274.463 InChI Key: VKLOPQHLJNFYKK-UHFFFAOYSA-N Synonym: 3-(Laurylthio)propionic Acid PubChem CID: 73834 IUPAC Name: 3-dodecylsulfanylpropanoic acid SMILES: CCCCCCCCCCCCSCCC(=O)O
| PubChem CID | 73834 |
|---|---|
| CAS | 1462-52-8 |
| Molecular Weight (g/mol) | 274.463 |
| SMILES | CCCCCCCCCCCCSCCC(=O)O |
| Synonym | 3-(Laurylthio)propionic Acid |
| IUPAC Name | 3-dodecylsulfanylpropanoic acid |
| InChI Key | VKLOPQHLJNFYKK-UHFFFAOYSA-N |
| Molecular Formula | C15H30O2S |
Cyclopentanecarboxylic Acid 98.0+%, TCI America™
CAS: 3400-45-1 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00001371 InChI Key: JBDSSBMEKXHSJF-UHFFFAOYSA-N Synonym: cyclopentane carboxylic acid,cyclopentylcarboxylic acid,cyclopentancarboxylic acid,cyclopentanoic acid,unii-z6691vh94a,cyclopentylmethanoic acid,pubchem14153,carboxycyclopentane,cyclopentyl carboxylic acid,acmc-209i4g PubChem CID: 18840 IUPAC Name: cyclopentanecarboxylic acid SMILES: C1CCC(C1)C(=O)O
| PubChem CID | 18840 |
|---|---|
| CAS | 3400-45-1 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00001371 |
| SMILES | C1CCC(C1)C(=O)O |
| Synonym | cyclopentane carboxylic acid,cyclopentylcarboxylic acid,cyclopentancarboxylic acid,cyclopentanoic acid,unii-z6691vh94a,cyclopentylmethanoic acid,pubchem14153,carboxycyclopentane,cyclopentyl carboxylic acid,acmc-209i4g |
| IUPAC Name | cyclopentanecarboxylic acid |
| InChI Key | JBDSSBMEKXHSJF-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
3-(3-Pyridyl)acrylic Acid 98.0+%, TCI America™
CAS: 1126-74-5 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00006410 InChI Key: VUVORVXMOLQFMO-ONEGZZNKSA-N Synonym: 3-3-pyridyl acrylic acid,trans-3-3-pyridyl acrylic acid,e-3-pyridin-3-yl acrylic acid,3-pyridylacrylic acid,2e-3-pyridin-3-ylacrylic acid,2e-3-pyridin-3-yl prop-2-enoic acid,3-pyridin-3-yl acrylic acid,trans-3-3'-pyridyl acrylic acid,3-3-pyridinyl acrylic acid,3-pyridinyl-acrylic acid PubChem CID: 776396 IUPAC Name: (E)-3-pyridin-3-ylprop-2-enoic acid SMILES: C1=CC(=CN=C1)C=CC(=O)O
| PubChem CID | 776396 |
|---|---|
| CAS | 1126-74-5 |
| Molecular Weight (g/mol) | 149.149 |
| MDL Number | MFCD00006410 |
| SMILES | C1=CC(=CN=C1)C=CC(=O)O |
| Synonym | 3-3-pyridyl acrylic acid,trans-3-3-pyridyl acrylic acid,e-3-pyridin-3-yl acrylic acid,3-pyridylacrylic acid,2e-3-pyridin-3-ylacrylic acid,2e-3-pyridin-3-yl prop-2-enoic acid,3-pyridin-3-yl acrylic acid,trans-3-3'-pyridyl acrylic acid,3-3-pyridinyl acrylic acid,3-pyridinyl-acrylic acid |
| IUPAC Name | (E)-3-pyridin-3-ylprop-2-enoic acid |
| InChI Key | VUVORVXMOLQFMO-ONEGZZNKSA-N |
| Molecular Formula | C8H7NO2 |
Rhodium(II) Acetate Dimer, TCI America™
CAS: 15956-28-2 Molecular Formula: C8H12O8Rh2 Molecular Weight (g/mol): 441.99 MDL Number: MFCD00003538 InChI Key: VOXKIADTKKPBBP-UHFFFAOYSA-N Synonym: rhodium ii acetate,rhodium diacetate,acetic acid, rhodium 2+ salt,rhodium ii acetate dimer dihydrate,dirhodium tetraacetate,rhodium ii acetate dimer,rhodium acetate, brown, water soluble,diacetoxyrhodium PubChem CID: 122130469 IUPAC Name: tetramethyl-2,4,6,8,9,11,12,14-octaoxa-1,5-dirhodatetracyclo[3.3.3.3¹,⁵.0¹,⁵]tetradecane-1,1,5,5-tetrakis(ylium)-3,7,10,13-tetraide SMILES: C[C-]1O[Rh++]234O[C-](C)O[Rh++]2(O1)(O[C-](C)O3)O[C-](C)O4
| PubChem CID | 122130469 |
|---|---|
| CAS | 15956-28-2 |
| Molecular Weight (g/mol) | 441.99 |
| MDL Number | MFCD00003538 |
| SMILES | C[C-]1O[Rh++]234O[C-](C)O[Rh++]2(O1)(O[C-](C)O3)O[C-](C)O4 |
| Synonym | rhodium ii acetate,rhodium diacetate,acetic acid, rhodium 2+ salt,rhodium ii acetate dimer dihydrate,dirhodium tetraacetate,rhodium ii acetate dimer,rhodium acetate, brown, water soluble,diacetoxyrhodium |
| IUPAC Name | tetramethyl-2,4,6,8,9,11,12,14-octaoxa-1,5-dirhodatetracyclo[3.3.3.3¹,⁵.0¹,⁵]tetradecane-1,1,5,5-tetrakis(ylium)-3,7,10,13-tetraide |
| InChI Key | VOXKIADTKKPBBP-UHFFFAOYSA-N |
| Molecular Formula | C8H12O8Rh2 |
Allyl Acetate 97.0+%, TCI America™
CAS: 591-87-7 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.117 MDL Number: MFCD00008721 InChI Key: FWZUNOYOVVKUNF-UHFFFAOYSA-N Synonym: allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i PubChem CID: 11584 IUPAC Name: prop-2-enyl acetate SMILES: CC(=O)OCC=C
| PubChem CID | 11584 |
|---|---|
| CAS | 591-87-7 |
| Molecular Weight (g/mol) | 100.117 |
| MDL Number | MFCD00008721 |
| SMILES | CC(=O)OCC=C |
| Synonym | allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i |
| IUPAC Name | prop-2-enyl acetate |
| InChI Key | FWZUNOYOVVKUNF-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
tert-Butyl Cyanoacetate 97.0+%, TCI America™
CAS: 1116-98-9 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00001938 InChI Key: BFNYNEMRWHFIMR-UHFFFAOYSA-N Synonym: tert-butyl cyanoacetate,t-butyl cyanoacetate,acetic acid, cyano-, 1,1-dimethylethyl ester,cyanoacetic acid tert-butyl ester,acetic acid, cyano-, tert-butyl ester,acetic acid, 2-cyano-, 1,1-dimethylethyl ester,tert-butylcyanacetat,t-butylcyanoacetate,tert-butylcyanoacetate,tert butyl cyanoacetate PubChem CID: 70693 IUPAC Name: tert-butyl 2-cyanoacetate SMILES: CC(C)(C)OC(=O)CC#N
| PubChem CID | 70693 |
|---|---|
| CAS | 1116-98-9 |
| Molecular Weight (g/mol) | 141.17 |
| MDL Number | MFCD00001938 |
| SMILES | CC(C)(C)OC(=O)CC#N |
| Synonym | tert-butyl cyanoacetate,t-butyl cyanoacetate,acetic acid, cyano-, 1,1-dimethylethyl ester,cyanoacetic acid tert-butyl ester,acetic acid, cyano-, tert-butyl ester,acetic acid, 2-cyano-, 1,1-dimethylethyl ester,tert-butylcyanacetat,t-butylcyanoacetate,tert-butylcyanoacetate,tert butyl cyanoacetate |
| IUPAC Name | tert-butyl 2-cyanoacetate |
| InChI Key | BFNYNEMRWHFIMR-UHFFFAOYSA-N |
| Molecular Formula | C7H11NO2 |
Isopropyl Hexanoate 98.0+%, TCI America™
CAS: 2311-46-8 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD00059436 InChI Key: JSHDAORXSNJOBA-UHFFFAOYSA-N Synonym: Hexanoic Acid Isopropyl Ester PubChem CID: 16832 IUPAC Name: propan-2-yl hexanoate SMILES: CCCCCC(=O)OC(C)C
| PubChem CID | 16832 |
|---|---|
| CAS | 2311-46-8 |
| Molecular Weight (g/mol) | 158.241 |
| MDL Number | MFCD00059436 |
| SMILES | CCCCCC(=O)OC(C)C |
| Synonym | Hexanoic Acid Isopropyl Ester |
| IUPAC Name | propan-2-yl hexanoate |
| InChI Key | JSHDAORXSNJOBA-UHFFFAOYSA-N |
| Molecular Formula | C9H18O2 |
Ethyl Laurate 99.0+%, TCI America™
CAS: 106-33-2 Molecular Formula: C14H28O2 Molecular Weight (g/mol): 228.38 MDL Number: MFCD00015065 InChI Key: MMXKVMNBHPAILY-UHFFFAOYSA-N Synonym: ethyl laurate,dodecanoic acid, ethyl ester,ethyl laurinate,ethyl dodecylate,lauric acid ethyl ester,lauric acid, ethyl ester,ethyl laurate natural,dodecanoic acid ethyl ester,ethyl n-dodecanote,unii-f389d4md5k PubChem CID: 7800 ChEBI: CHEBI:87427 IUPAC Name: ethyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCC
| PubChem CID | 7800 |
|---|---|
| CAS | 106-33-2 |
| Molecular Weight (g/mol) | 228.38 |
| ChEBI | CHEBI:87427 |
| MDL Number | MFCD00015065 |
| SMILES | CCCCCCCCCCCC(=O)OCC |
| Synonym | ethyl laurate,dodecanoic acid, ethyl ester,ethyl laurinate,ethyl dodecylate,lauric acid ethyl ester,lauric acid, ethyl ester,ethyl laurate natural,dodecanoic acid ethyl ester,ethyl n-dodecanote,unii-f389d4md5k |
| IUPAC Name | ethyl dodecanoate |
| InChI Key | MMXKVMNBHPAILY-UHFFFAOYSA-N |
| Molecular Formula | C14H28O2 |
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 |
Benzyl Formate 95.0+%, TCI America™
CAS: 104-57-4 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00014128 InChI Key: UYWQUFXKFGHYNT-UHFFFAOYSA-N Synonym: formic acid, phenylmethyl ester,benzyl methanoate,phenylmethyl formate,benzyl alcohol, formate,formic acid benzyl ester,benzyl formiat,formic acid, benzyl ester,benzylester kyseliny mravenci,ameisensaeurebenzylester,carbobenzoxy group PubChem CID: 7708 ChEBI: CHEBI:3057 IUPAC Name: benzyl formate SMILES: C1=CC=C(C=C1)COC=O
| PubChem CID | 7708 |
|---|---|
| CAS | 104-57-4 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:3057 |
| MDL Number | MFCD00014128 |
| SMILES | C1=CC=C(C=C1)COC=O |
| Synonym | formic acid, phenylmethyl ester,benzyl methanoate,phenylmethyl formate,benzyl alcohol, formate,formic acid benzyl ester,benzyl formiat,formic acid, benzyl ester,benzylester kyseliny mravenci,ameisensaeurebenzylester,carbobenzoxy group |
| IUPAC Name | benzyl formate |
| InChI Key | UYWQUFXKFGHYNT-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
cis-3-Hexenyl Pyruvate 95.0+%, TCI America™
CAS: 68133-76-6 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00036527 InChI Key: LKNXTZXOBHAYSR-PLNGDYQASA-N Synonym: Pyruvic Acid cis-3-Hexenyl Ester PubChem CID: 5363291 IUPAC Name: (3Z)-hex-3-en-1-yl 2-oxopropanoate SMILES: CC\C=C/CCOC(=O)C(C)=O
| PubChem CID | 5363291 |
|---|---|
| CAS | 68133-76-6 |
| Molecular Weight (g/mol) | 170.21 |
| MDL Number | MFCD00036527 |
| SMILES | CC\C=C/CCOC(=O)C(C)=O |
| Synonym | Pyruvic Acid cis-3-Hexenyl Ester |
| IUPAC Name | (3Z)-hex-3-en-1-yl 2-oxopropanoate |
| InChI Key | LKNXTZXOBHAYSR-PLNGDYQASA-N |
| Molecular Formula | C9H14O3 |