Organic acids and derivatives
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Ethyl Tridecanoate 97.0+%, TCI America™
CAS: 28267-29-0 Molecular Formula: C15H30O2 Molecular Weight (g/mol): 242.403 MDL Number: MFCD00008978 InChI Key: QJYYMNOTJXIOBP-UHFFFAOYSA-N Synonym: tridecanoic acid ethyl ester,tridecanoic acid, ethyl ester,ethyltridecanoate,ethyl=tridecanoate,tridecanoic acid, ethylester,acmc-1cr51,ethyl tridecanoate,n-tridecanoic acid ethyl ester PubChem CID: 119908 IUPAC Name: ethyl tridecanoate SMILES: CCCCCCCCCCCCC(=O)OCC
| PubChem CID | 119908 |
|---|---|
| CAS | 28267-29-0 |
| Molecular Weight (g/mol) | 242.403 |
| MDL Number | MFCD00008978 |
| SMILES | CCCCCCCCCCCCC(=O)OCC |
| Synonym | tridecanoic acid ethyl ester,tridecanoic acid, ethyl ester,ethyltridecanoate,ethyl=tridecanoate,tridecanoic acid, ethylester,acmc-1cr51,ethyl tridecanoate,n-tridecanoic acid ethyl ester |
| IUPAC Name | ethyl tridecanoate |
| InChI Key | QJYYMNOTJXIOBP-UHFFFAOYSA-N |
| Molecular Formula | C15H30O2 |
Phthalimidoacetaldehyde 98.0+%, TCI America™
CAS: 2913-97-5 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00023080 InChI Key: LMRDBJZQDUVCQH-UHFFFAOYSA-N Synonym: N-(Formylmethyl)phthalimide PubChem CID: 76201 IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)acetaldehyde SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CC=O
| PubChem CID | 76201 |
|---|---|
| CAS | 2913-97-5 |
| Molecular Weight (g/mol) | 189.17 |
| MDL Number | MFCD00023080 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CC=O |
| Synonym | N-(Formylmethyl)phthalimide |
| IUPAC Name | 2-(1,3-dioxoisoindol-2-yl)acetaldehyde |
| InChI Key | LMRDBJZQDUVCQH-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO3 |
Sodium Isethionate 98.0+%, TCI America™
CAS: 1562-00-1 Molecular Formula: C2H5NaO4S Molecular Weight (g/mol): 148.108 MDL Number: MFCD00007534 InChI Key: LADXKQRVAFSPTR-UHFFFAOYSA-M Synonym: sodium 2-hydroxyethanesulfonate,sodium isethionate,isethionic acid sodium salt,2-hydroxyethanesulfonic acid sodium salt,sodium hydroxyethylsulfonate,ethanesulfonic acid, 2-hydroxy-, monosodium salt,sodium 2-hydroxyethylsulfonate,sodium 2-hydroxyethanesulphonate,sodium beta-hydroxyethanesulfonate,sodium 1-hydroxy-2-ethanesulfonate PubChem CID: 517063 IUPAC Name: sodium;2-hydroxyethanesulfonate SMILES: C(CS(=O)(=O)[O-])O.[Na+]
| PubChem CID | 517063 |
|---|---|
| CAS | 1562-00-1 |
| Molecular Weight (g/mol) | 148.108 |
| MDL Number | MFCD00007534 |
| SMILES | C(CS(=O)(=O)[O-])O.[Na+] |
| Synonym | sodium 2-hydroxyethanesulfonate,sodium isethionate,isethionic acid sodium salt,2-hydroxyethanesulfonic acid sodium salt,sodium hydroxyethylsulfonate,ethanesulfonic acid, 2-hydroxy-, monosodium salt,sodium 2-hydroxyethylsulfonate,sodium 2-hydroxyethanesulphonate,sodium beta-hydroxyethanesulfonate,sodium 1-hydroxy-2-ethanesulfonate |
| IUPAC Name | sodium;2-hydroxyethanesulfonate |
| InChI Key | LADXKQRVAFSPTR-UHFFFAOYSA-M |
| Molecular Formula | C2H5NaO4S |
Isopropyl Cinnamate 98.0+%, TCI America™
CAS: 7780-06-5 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00048292 InChI Key: RGACABDFLVLVCT-CMDGGOBGSA-N Synonym: isopropyl cinnamate,cinnamic acid, isopropyl ester,iso-propyl cinnamate,2-propenoic acid, 3-phenyl-, 1-methylethyl ester,1-methylethyl 3-phenylpropenoate,unii-6rwc10bdd7,isopropyl 3-phenylpropenoate,fema no. 2939,trans-cinnamic acid isopropyl ester,isopropyl 3-phenylacrylate PubChem CID: 5273464 IUPAC Name: propan-2-yl (E)-3-phenylprop-2-enoate SMILES: CC(C)OC(=O)C=CC1=CC=CC=C1
| PubChem CID | 5273464 |
|---|---|
| CAS | 7780-06-5 |
| Molecular Weight (g/mol) | 190.24 |
| MDL Number | MFCD00048292 |
| SMILES | CC(C)OC(=O)C=CC1=CC=CC=C1 |
| Synonym | isopropyl cinnamate,cinnamic acid, isopropyl ester,iso-propyl cinnamate,2-propenoic acid, 3-phenyl-, 1-methylethyl ester,1-methylethyl 3-phenylpropenoate,unii-6rwc10bdd7,isopropyl 3-phenylpropenoate,fema no. 2939,trans-cinnamic acid isopropyl ester,isopropyl 3-phenylacrylate |
| IUPAC Name | propan-2-yl (E)-3-phenylprop-2-enoate |
| InChI Key | RGACABDFLVLVCT-CMDGGOBGSA-N |
| Molecular Formula | C12H14O2 |
Methyl 3-Mercaptopropionate 98.0+%, TCI America™
CAS: 2935-90-2 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.166 MDL Number: MFCD00004895 InChI Key: LDTLDBDUBGAEDT-UHFFFAOYSA-N Synonym: methyl 3-mercaptopropionate,propanoic acid, 3-mercapto-, methyl ester,3-mercaptopropionic acid methyl ester,methyl mercaptopropionate,methyl3-mercaptopropionate,methyl 3-mercaptopropanoate,propionic acid, 3-mercapto-, methyl ester,unii-v920f0bcrz,methyl-3-mercaptopropionate,v920f0bcrz PubChem CID: 18050 IUPAC Name: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS
| PubChem CID | 18050 |
|---|---|
| CAS | 2935-90-2 |
| Molecular Weight (g/mol) | 120.166 |
| MDL Number | MFCD00004895 |
| SMILES | COC(=O)CCS |
| Synonym | methyl 3-mercaptopropionate,propanoic acid, 3-mercapto-, methyl ester,3-mercaptopropionic acid methyl ester,methyl mercaptopropionate,methyl3-mercaptopropionate,methyl 3-mercaptopropanoate,propionic acid, 3-mercapto-, methyl ester,unii-v920f0bcrz,methyl-3-mercaptopropionate,v920f0bcrz |
| IUPAC Name | methyl 3-sulfanylpropanoate |
| InChI Key | LDTLDBDUBGAEDT-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2S |
N-tert-Butylacrylamide 98.0+%, TCI America™
CAS: 107-58-4 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.19 MDL Number: MFCD00026271 InChI Key: XFHJDMUEHUHAJW-UHFFFAOYSA-N Synonym: n-tert-butylacrylamide,tert-butylacrylamide,n-tert-butyl acrylamide,2-propenamide, n-1,1-dimethylethyl,acrylamide, n-tert-butyl,n-t-butylacrylamide,unii-xj13fsh48k,n-1,1-dimethylethyl-2-propenamide,xj13fsh48k,n-tert-butyl prop-2-enamide PubChem CID: 7877 IUPAC Name: N-tert-butylprop-2-enamide SMILES: CC(C)(C)NC(=O)C=C
| PubChem CID | 7877 |
|---|---|
| CAS | 107-58-4 |
| Molecular Weight (g/mol) | 127.19 |
| MDL Number | MFCD00026271 |
| SMILES | CC(C)(C)NC(=O)C=C |
| Synonym | n-tert-butylacrylamide,tert-butylacrylamide,n-tert-butyl acrylamide,2-propenamide, n-1,1-dimethylethyl,acrylamide, n-tert-butyl,n-t-butylacrylamide,unii-xj13fsh48k,n-1,1-dimethylethyl-2-propenamide,xj13fsh48k,n-tert-butyl prop-2-enamide |
| IUPAC Name | N-tert-butylprop-2-enamide |
| InChI Key | XFHJDMUEHUHAJW-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO |
(2-Chloroethyl)phosphonic Acid 98.0+%, TCI America™
CAS: 16672-87-0 Molecular Formula: C2H6ClO3P Molecular Weight (g/mol): 144.49 MDL Number: MFCD00002142 InChI Key: UDPGUMQDCGORJQ-UHFFFAOYSA-N Synonym: ethephon,2-chloroethyl phosphonic acid,ethrel,chlorethephon,bromeflor,camposan,2-cepa,phosphonic acid, 2-chloroethyl,2-chloroethanephosphonic acid,etheverse PubChem CID: 27982 ChEBI: CHEBI:52741 IUPAC Name: (2-chloroethyl)phosphonic acid SMILES: OP(O)(=O)CCCl
| PubChem CID | 27982 |
|---|---|
| CAS | 16672-87-0 |
| Molecular Weight (g/mol) | 144.49 |
| ChEBI | CHEBI:52741 |
| MDL Number | MFCD00002142 |
| SMILES | OP(O)(=O)CCCl |
| Synonym | ethephon,2-chloroethyl phosphonic acid,ethrel,chlorethephon,bromeflor,camposan,2-cepa,phosphonic acid, 2-chloroethyl,2-chloroethanephosphonic acid,etheverse |
| IUPAC Name | (2-chloroethyl)phosphonic acid |
| InChI Key | UDPGUMQDCGORJQ-UHFFFAOYSA-N |
| Molecular Formula | C2H6ClO3P |
Sodium Dichloroacetate 99.0+%, TCI America™
CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium 2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl
| PubChem CID | 517326 |
|---|---|
| CAS | 2156-56-1 |
| Molecular Weight (g/mol) | 150.92 |
| MDL Number | MFCD00070489 |
| SMILES | [Na+].[O-]C(=O)C(Cl)Cl |
| Synonym | sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt |
| IUPAC Name | sodium 2,2-dichloroacetate |
| InChI Key | LUPNKHXLFSSUGS-UHFFFAOYSA-M |
| Molecular Formula | C2HCl2NaO2 |
Nicotinic Acid Hydrazide 98.0+%, TCI America™
CAS: 553-53-7 Molecular Formula: C6H7N3O Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006383 InChI Key: KFUSANSHCADHNJ-UHFFFAOYSA-N Synonym: nicotinohydrazide,nicotinic acid hydrazide,nicotinic hydrazide,niazid,nicotinylhydrazide,nicotinoyl hydrazine,3-pyridoyl hydrazine,3-pyridylcarbonylhydrazine,nicotinoyl hydrazide,hydrazine, nicotinoyl PubChem CID: 11112 IUPAC Name: pyridine-3-carbohydrazide SMILES: NNC(=O)C1=CC=CN=C1
| PubChem CID | 11112 |
|---|---|
| CAS | 553-53-7 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD00006383 |
| SMILES | NNC(=O)C1=CC=CN=C1 |
| Synonym | nicotinohydrazide,nicotinic acid hydrazide,nicotinic hydrazide,niazid,nicotinylhydrazide,nicotinoyl hydrazine,3-pyridoyl hydrazine,3-pyridylcarbonylhydrazine,nicotinoyl hydrazide,hydrazine, nicotinoyl |
| IUPAC Name | pyridine-3-carbohydrazide |
| InChI Key | KFUSANSHCADHNJ-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O |
Methyl Trifluoromethanesulfonate 98.0+%, TCI America™
CAS: 333-27-7 Molecular Formula: C2H3F3O3S Molecular Weight (g/mol): 164.10 MDL Number: MFCD00000409 InChI Key: OIRDBPQYVWXNSJ-UHFFFAOYSA-N Synonym: methyl triflate,methyl trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, methyl ester,triflate ester,methyl trifluoromethane sulfonate,trifluoromethanesulfonic acid methyl ester,unii-7b25z22epv,ccris 1158,methyltrifluoromethanesulfonate,methanesulfonic acid, 1,1,1-trifluoro-, methyl ester PubChem CID: 9526 IUPAC Name: methyl trifluoromethanesulfonate SMILES: COS(=O)(=O)C(F)(F)F
| PubChem CID | 9526 |
|---|---|
| CAS | 333-27-7 |
| Molecular Weight (g/mol) | 164.10 |
| MDL Number | MFCD00000409 |
| SMILES | COS(=O)(=O)C(F)(F)F |
| Synonym | methyl triflate,methyl trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, methyl ester,triflate ester,methyl trifluoromethane sulfonate,trifluoromethanesulfonic acid methyl ester,unii-7b25z22epv,ccris 1158,methyltrifluoromethanesulfonate,methanesulfonic acid, 1,1,1-trifluoro-, methyl ester |
| IUPAC Name | methyl trifluoromethanesulfonate |
| InChI Key | OIRDBPQYVWXNSJ-UHFFFAOYSA-N |
| Molecular Formula | C2H3F3O3S |
o-Tolylacetic Acid 98.0+%, TCI America™
CAS: 644-36-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004328 InChI Key: RZWGTXHSYZGXKF-UHFFFAOYSA-N Synonym: o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid PubChem CID: 69519 IUPAC Name: 2-(2-methylphenyl)acetic acid SMILES: CC1=CC=CC=C1CC(=O)O
| PubChem CID | 69519 |
|---|---|
| CAS | 644-36-0 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00004328 |
| SMILES | CC1=CC=CC=C1CC(=O)O |
| Synonym | o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid |
| IUPAC Name | 2-(2-methylphenyl)acetic acid |
| InChI Key | RZWGTXHSYZGXKF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
4-Hydroxybutyl Acrylate (stabilized with MEHQ) 97.0+%, TCI America™
CAS: 2478-10-6 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00010261 InChI Key: NDWUBGAGUCISDV-UHFFFAOYSA-N Synonym: 4-hydroxybutyl acrylate,acrylic acid 4-hydroxybutyl ester,hydroxybutyl acrylate,1,4-butanediol monoacrylate,2-propenoic acid, 4-hydroxybutyl ester,unii-4o2a4het1x,4o2a4het1x,hydroxybutylacrylate,4-hydroxybutylacrylate,4-hydroxy-butyl acrylate PubChem CID: 75588 IUPAC Name: 4-hydroxybutyl prop-2-enoate SMILES: C=CC(=O)OCCCCO
| PubChem CID | 75588 |
|---|---|
| CAS | 2478-10-6 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00010261 |
| SMILES | C=CC(=O)OCCCCO |
| Synonym | 4-hydroxybutyl acrylate,acrylic acid 4-hydroxybutyl ester,hydroxybutyl acrylate,1,4-butanediol monoacrylate,2-propenoic acid, 4-hydroxybutyl ester,unii-4o2a4het1x,4o2a4het1x,hydroxybutylacrylate,4-hydroxybutylacrylate,4-hydroxy-butyl acrylate |
| IUPAC Name | 4-hydroxybutyl prop-2-enoate |
| InChI Key | NDWUBGAGUCISDV-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
1H,1H,2H,2H-Tridecafluoro-n-octyl Acrylate (stabilized with HQ + MEHQ) 98.0+%, TCI America™
CAS: 17527-29-6 Molecular Formula: C11H7F13O2 Molecular Weight (g/mol): 418.15 MDL Number: MFCD00042351 InChI Key: VPKQPPJQTZJZDB-UHFFFAOYSA-N Synonym: Acrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester PubChem CID: 87149 IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl prop-2-enoate SMILES: FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C
| PubChem CID | 87149 |
|---|---|
| CAS | 17527-29-6 |
| Molecular Weight (g/mol) | 418.15 |
| MDL Number | MFCD00042351 |
| SMILES | FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C |
| Synonym | Acrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester |
| IUPAC Name | 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl prop-2-enoate |
| InChI Key | VPKQPPJQTZJZDB-UHFFFAOYSA-N |
| Molecular Formula | C11H7F13O2 |
Glycine-N,N-bis(methylenephosphonic Acid) 97.0+%, TCI America™
CAS: 2439-99-8 Molecular Formula: C4H11NO8P2 Molecular Weight (g/mol): 263.079 MDL Number: MFCD00056670 InChI Key: OXHDYFKENBXUEM-UHFFFAOYSA-N Synonym: glyphosine,n,n-bis phosphonomethyl glycine,glyphosphine,polaris,2-bis phosphonomethyl amino acetic acid,glycine, n,n-bis phosphonomethyl,glyphosine ansi,caswell no. 471a,unii-2u96121skr PubChem CID: 17112 ChEBI: CHEBI:63484 IUPAC Name: 2-[bis(phosphonomethyl)amino]acetic acid SMILES: C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O
| PubChem CID | 17112 |
|---|---|
| CAS | 2439-99-8 |
| Molecular Weight (g/mol) | 263.079 |
| ChEBI | CHEBI:63484 |
| MDL Number | MFCD00056670 |
| SMILES | C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O |
| Synonym | glyphosine,n,n-bis phosphonomethyl glycine,glyphosphine,polaris,2-bis phosphonomethyl amino acetic acid,glycine, n,n-bis phosphonomethyl,glyphosine ansi,caswell no. 471a,unii-2u96121skr |
| IUPAC Name | 2-[bis(phosphonomethyl)amino]acetic acid |
| InChI Key | OXHDYFKENBXUEM-UHFFFAOYSA-N |
| Molecular Formula | C4H11NO8P2 |
Sodium 2-Mercaptoethanesulfonate 95.0+%, TCI America™
CAS: 19767-45-4 Molecular Formula: C2H5NaO3S2 Molecular Weight (g/mol): 164.169 MDL Number: MFCD00007535 InChI Key: XOGTZOOQQBDUSI-UHFFFAOYSA-M Synonym: mesna,sodium 2-mercaptoethanesulfonate,mesnex,uromitexan,mitexan,2-mercaptoethanesulfonic acid sodium salt,mistabron,mesnum,mistabronco,mucofluid PubChem CID: 23662354 IUPAC Name: sodium;2-sulfanylethanesulfonate SMILES: C(CS(=O)(=O)[O-])S.[Na+]
| PubChem CID | 23662354 |
|---|---|
| CAS | 19767-45-4 |
| Molecular Weight (g/mol) | 164.169 |
| MDL Number | MFCD00007535 |
| SMILES | C(CS(=O)(=O)[O-])S.[Na+] |
| Synonym | mesna,sodium 2-mercaptoethanesulfonate,mesnex,uromitexan,mitexan,2-mercaptoethanesulfonic acid sodium salt,mistabron,mesnum,mistabronco,mucofluid |
| IUPAC Name | sodium;2-sulfanylethanesulfonate |
| InChI Key | XOGTZOOQQBDUSI-UHFFFAOYSA-M |
| Molecular Formula | C2H5NaO3S2 |