Organic acids and derivatives
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Pentaerythritol Tetrastearate (so called) 95.0+%, TCI America™
CAS: 115-83-3 Molecular Formula: C77H148O8 Molecular Weight (g/mol): 1202.02 MDL Number: MFCD00041922 InChI Key: OCKWAZCWKSMKNC-UHFFFAOYSA-N Synonym: pentaerythrityl tetrastearate,pentaerythritol tetrastearate,unii-w9q3dzs0eg,stearic acid, neopentanetetrayl ester,w9q3dzs0eg,3-octadecanoyloxy-2,2-bis octadecanoyloxymethyl propyl octadecanoate,octadecanoic acid, 2,2-bis 1-oxooctadecyl oxy methyl-1,3-propanediyl ester,pe tetrastearate,pentaerythrittetrastearat PubChem CID: 61037 IUPAC Name: 3-(octadecanoyloxy)-2,2-bis[(octadecanoyloxy)methyl]propyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
| PubChem CID | 61037 |
|---|---|
| CAS | 115-83-3 |
| Molecular Weight (g/mol) | 1202.02 |
| MDL Number | MFCD00041922 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC |
| Synonym | pentaerythrityl tetrastearate,pentaerythritol tetrastearate,unii-w9q3dzs0eg,stearic acid, neopentanetetrayl ester,w9q3dzs0eg,3-octadecanoyloxy-2,2-bis octadecanoyloxymethyl propyl octadecanoate,octadecanoic acid, 2,2-bis 1-oxooctadecyl oxy methyl-1,3-propanediyl ester,pe tetrastearate,pentaerythrittetrastearat |
| IUPAC Name | 3-(octadecanoyloxy)-2,2-bis[(octadecanoyloxy)methyl]propyl octadecanoate |
| InChI Key | OCKWAZCWKSMKNC-UHFFFAOYSA-N |
| Molecular Formula | C77H148O8 |
Methyl (R)-(-)-3-Hydroxybutyrate 98.0+%, TCI America™
CAS: 3976-69-0 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00063289 InChI Key: LDLDJEAVRNAEBW-SCSAIBSYSA-N Synonym: methyl r---3-hydroxybutyrate,r-methyl 3-hydroxybutanoate,methyl 3r-3-hydroxybutanoate,methyl r-3-hydroxybutyrate,r-3-hydroxybutyric acid methyl ester,methyl r-3-hydroxybutanoate,r---3-hydroxybutyric acid methyl ester,r---methyl 3-hydroxybutyrate,r---3-hydroxy-n-butyric acid methyl ester PubChem CID: 2724279 IUPAC Name: methyl (3R)-3-hydroxybutanoate SMILES: CC(CC(=O)OC)O
| PubChem CID | 2724279 |
|---|---|
| CAS | 3976-69-0 |
| Molecular Weight (g/mol) | 118.132 |
| MDL Number | MFCD00063289 |
| SMILES | CC(CC(=O)OC)O |
| Synonym | methyl r---3-hydroxybutyrate,r-methyl 3-hydroxybutanoate,methyl 3r-3-hydroxybutanoate,methyl r-3-hydroxybutyrate,r-3-hydroxybutyric acid methyl ester,methyl r-3-hydroxybutanoate,r---3-hydroxybutyric acid methyl ester,r---methyl 3-hydroxybutyrate,r---3-hydroxy-n-butyric acid methyl ester |
| IUPAC Name | methyl (3R)-3-hydroxybutanoate |
| InChI Key | LDLDJEAVRNAEBW-SCSAIBSYSA-N |
| Molecular Formula | C5H10O3 |
Diammonium Ethylenediaminetetraacetate Monohydrate 98.0+%, TCI America™
CAS: 304675-80-7 Molecular Formula: C10H24N4O9 Molecular Weight (g/mol): 344.321 InChI Key: WRSUMHYBOYWMTD-UHFFFAOYSA-N Synonym: Diammonium EDTA, Ethylenediaminetetraacetic Acid Diammonium Salt PubChem CID: 18446095 IUPAC Name: diazanium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.[NH4+].[NH4+].O
| PubChem CID | 18446095 |
|---|---|
| CAS | 304675-80-7 |
| Molecular Weight (g/mol) | 344.321 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.[NH4+].[NH4+].O |
| Synonym | Diammonium EDTA, Ethylenediaminetetraacetic Acid Diammonium Salt |
| IUPAC Name | diazanium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate |
| InChI Key | WRSUMHYBOYWMTD-UHFFFAOYSA-N |
| Molecular Formula | C10H24N4O9 |
1H,1H,2H,2H-Nonafluorohexyl Acrylate (stabilized with TBC) 98.0+%, TCI America™
CAS: 52591-27-2 Molecular Formula: C9H7F9O2 Molecular Weight (g/mol): 318.14 MDL Number: MFCD00236104 InChI Key: GYUPEJSTJSFVRR-UHFFFAOYSA-N Synonym: Acrylic Acid 1H,1H,2H,2H-Nonafluorohexyl Ester, 3,3,4,4,5,5,6,6,6-Nonafluorohexyl Acrylate, Acrylic Acid 3,3,4,4,5,5,6,6,6-Nonafluorohexyl Ester PubChem CID: 104247 IUPAC Name: 3,3,4,4,5,5,6,6,6-nonafluorohexyl prop-2-enoate SMILES: FC(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C
| PubChem CID | 104247 |
|---|---|
| CAS | 52591-27-2 |
| Molecular Weight (g/mol) | 318.14 |
| MDL Number | MFCD00236104 |
| SMILES | FC(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C |
| Synonym | Acrylic Acid 1H,1H,2H,2H-Nonafluorohexyl Ester, 3,3,4,4,5,5,6,6,6-Nonafluorohexyl Acrylate, Acrylic Acid 3,3,4,4,5,5,6,6,6-Nonafluorohexyl Ester |
| IUPAC Name | 3,3,4,4,5,5,6,6,6-nonafluorohexyl prop-2-enoate |
| InChI Key | GYUPEJSTJSFVRR-UHFFFAOYSA-N |
| Molecular Formula | C9H7F9O2 |
Isoamyl Isovalerate 98.0+%, TCI America™
CAS: 659-70-1 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00048369 InChI Key: XINCECQTMHSORG-UHFFFAOYSA-N Synonym: Isovaleric Acid Isoamyl Ester, Isopentyl Isovalerate, Isovaleric Acid Isopentyl Ester PubChem CID: 12613 ChEBI: CHEBI:31727 IUPAC Name: 3-methylbutyl 3-methylbutanoate SMILES: CC(C)CCOC(=O)CC(C)C
| PubChem CID | 12613 |
|---|---|
| CAS | 659-70-1 |
| Molecular Weight (g/mol) | 172.268 |
| ChEBI | CHEBI:31727 |
| MDL Number | MFCD00048369 |
| SMILES | CC(C)CCOC(=O)CC(C)C |
| Synonym | Isovaleric Acid Isoamyl Ester, Isopentyl Isovalerate, Isovaleric Acid Isopentyl Ester |
| IUPAC Name | 3-methylbutyl 3-methylbutanoate |
| InChI Key | XINCECQTMHSORG-UHFFFAOYSA-N |
| Molecular Formula | C10H20O2 |
5-Quinoxalinol 98.0+%, TCI America™
CAS: 17056-99-4 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.149 MDL Number: MFCD00972004 InChI Key: YDXPVVWMFFHSPT-UHFFFAOYSA-N Synonym: quinoxalin-5-ol,5-hydroxyquinoxaline,5-quinoxalinol,quinoxaline-5-ol,quinoxalin-5 1h-one,ksc172c0d,zuqddqfxsnxeod-uhfffaoysa-n PubChem CID: 12522983 IUPAC Name: 1H-quinoxalin-5-one SMILES: C1=CC(=O)C2=NC=CNC2=C1
| PubChem CID | 12522983 |
|---|---|
| CAS | 17056-99-4 |
| Molecular Weight (g/mol) | 146.149 |
| MDL Number | MFCD00972004 |
| SMILES | C1=CC(=O)C2=NC=CNC2=C1 |
| Synonym | quinoxalin-5-ol,5-hydroxyquinoxaline,5-quinoxalinol,quinoxaline-5-ol,quinoxalin-5 1h-one,ksc172c0d,zuqddqfxsnxeod-uhfffaoysa-n |
| IUPAC Name | 1H-quinoxalin-5-one |
| InChI Key | YDXPVVWMFFHSPT-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O |
Cyclohexylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 4441-56-9 Molecular Formula: C6H13BO2 MDL Number: MFCD01311824 InChI Key: XDRVAZAFNWDVOE-UHFFFAOYSA-N PubChem CID: 199578 IUPAC Name: cyclohexylboronic acid
| PubChem CID | 199578 |
|---|---|
| CAS | 4441-56-9 |
| MDL Number | MFCD01311824 |
| IUPAC Name | cyclohexylboronic acid |
| InChI Key | XDRVAZAFNWDVOE-UHFFFAOYSA-N |
| Molecular Formula | C6H13BO2 |
Acetoxy-2-propanone (stabilized with Mg6Al2(OH)16CO3.4H2O) 97.0+%, TCI America™
CAS: 592-20-1 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.116 MDL Number: MFCD00042848 InChI Key: DBERHVIZRVGDFO-UHFFFAOYSA-N Synonym: acetoxyacetone,acetonyl acetate,acetol acetate,2-propanone, 1-acetyloxy,acetoxypropanone,o-acetylacetol,1-acetoxyacetone,acetylmethyl acetate,acetoxy-2-propanone,1-acetoxy-2-propanone PubChem CID: 11593 IUPAC Name: 2-oxopropyl acetate SMILES: CC(=O)COC(=O)C
| PubChem CID | 11593 |
|---|---|
| CAS | 592-20-1 |
| Molecular Weight (g/mol) | 116.116 |
| MDL Number | MFCD00042848 |
| SMILES | CC(=O)COC(=O)C |
| Synonym | acetoxyacetone,acetonyl acetate,acetol acetate,2-propanone, 1-acetyloxy,acetoxypropanone,o-acetylacetol,1-acetoxyacetone,acetylmethyl acetate,acetoxy-2-propanone,1-acetoxy-2-propanone |
| IUPAC Name | 2-oxopropyl acetate |
| InChI Key | DBERHVIZRVGDFO-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |
Diphenylamine, 1% (w/v), Ricca Chemical
CAS: 7732-18-5 Molecular Formula: C12H11NNaO3S Molecular Weight (g/mol): Mixture MDL Number: MFCD00036468 InChI Key: VMVSDVIYIMNZBS-UHFFFAOYSA-N Synonym: sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt PubChem CID: 517002 IUPAC Name: 4-(phenylamino)benzene-1-sulfonic acid sodium SMILES: [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1
| PubChem CID | 517002 |
|---|---|
| CAS | 7732-18-5 |
| Molecular Weight (g/mol) | Mixture |
| MDL Number | MFCD00036468 |
| SMILES | [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1 |
| Synonym | sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt |
| IUPAC Name | 4-(phenylamino)benzene-1-sulfonic acid sodium |
| InChI Key | VMVSDVIYIMNZBS-UHFFFAOYSA-N |
| Molecular Formula | C12H11NNaO3S |
1H,1H,2H,2H-Tridecafluoro-n-octyl Methacrylate (stabilized with HQ + MEHQ) 98.0+%, TCI America™
CAS: 2144-53-8 Molecular Formula: C12H9F13O2 Molecular Weight (g/mol): 432.18 MDL Number: MFCD00077580 InChI Key: CDXFIRXEAJABAZ-UHFFFAOYSA-N Synonym: Methacrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Methacrylate, Methacrylic Acid 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Ester PubChem CID: 75066 IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
| PubChem CID | 75066 |
|---|---|
| CAS | 2144-53-8 |
| Molecular Weight (g/mol) | 432.18 |
| MDL Number | MFCD00077580 |
| SMILES | CC(=C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
| Synonym | Methacrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Methacrylate, Methacrylic Acid 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Ester |
| IUPAC Name | 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl 2-methylprop-2-enoate |
| InChI Key | CDXFIRXEAJABAZ-UHFFFAOYSA-N |
| Molecular Formula | C12H9F13O2 |
2,2,3,3-Tetrafluoropropionic Acid 95.0+%, TCI America™
CAS: 756-09-2 Molecular Formula: C3H2F4O2 Molecular Weight (g/mol): 146.041 MDL Number: MFCD00054686 InChI Key: PXRROZVNOOEPPZ-UHFFFAOYSA-N Synonym: flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa PubChem CID: 69789 ChEBI: CHEBI:82013 IUPAC Name: 2,2,3,3-tetrafluoropropanoic acid SMILES: C(C(C(=O)O)(F)F)(F)F
| PubChem CID | 69789 |
|---|---|
| CAS | 756-09-2 |
| Molecular Weight (g/mol) | 146.041 |
| ChEBI | CHEBI:82013 |
| MDL Number | MFCD00054686 |
| SMILES | C(C(C(=O)O)(F)F)(F)F |
| Synonym | flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa |
| IUPAC Name | 2,2,3,3-tetrafluoropropanoic acid |
| InChI Key | PXRROZVNOOEPPZ-UHFFFAOYSA-N |
| Molecular Formula | C3H2F4O2 |
Methyl 3-(4-Hydroxyphenyl)propionate 98.0+%, TCI America™
CAS: 5597-50-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00071577 InChI Key: XRAMJHXWXCMGJM-UHFFFAOYSA-N PubChem CID: 79706 IUPAC Name: methyl 3-(4-hydroxyphenyl)propanoate SMILES: COC(=O)CCC1=CC=C(C=C1)O
| PubChem CID | 79706 |
|---|---|
| CAS | 5597-50-2 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00071577 |
| SMILES | COC(=O)CCC1=CC=C(C=C1)O |
| IUPAC Name | methyl 3-(4-hydroxyphenyl)propanoate |
| InChI Key | XRAMJHXWXCMGJM-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
5-Norbornene-2-carboxylic Acid 98.0+%, TCI America™
CAS: 120-74-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00085356 InChI Key: FYGUSUBEMUKACF-UHFFFAOYSA-N Synonym: 5-norbornene-2-carboxylic acid,bicyclo 2.2.1 hept-5-ene-2-carboxylic acid,norbornenecarboxylic acid,exo-5-norbornene-2-carboxylic acid,5-norbornene-2-carboxylic acid, exo,5-norbornene-2-carboxylic acid 8ci,bicyclo 2.2.1 hept-2-ene-5-carboxylic acid,bicyclo 2.2.1-5-heptene-2-carboxylic acid,norborn-5-ene-2-carboxylic acid PubChem CID: 78949 IUPAC Name: bicyclo[2.2.1]hept-2-ene-5-carboxylic acid SMILES: C1C2CC(C1C=C2)C(=O)O
| PubChem CID | 78949 |
|---|---|
| CAS | 120-74-1 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00085356 |
| SMILES | C1C2CC(C1C=C2)C(=O)O |
| Synonym | 5-norbornene-2-carboxylic acid,bicyclo 2.2.1 hept-5-ene-2-carboxylic acid,norbornenecarboxylic acid,exo-5-norbornene-2-carboxylic acid,5-norbornene-2-carboxylic acid, exo,5-norbornene-2-carboxylic acid 8ci,bicyclo 2.2.1 hept-2-ene-5-carboxylic acid,bicyclo 2.2.1-5-heptene-2-carboxylic acid,norborn-5-ene-2-carboxylic acid |
| IUPAC Name | bicyclo[2.2.1]hept-2-ene-5-carboxylic acid |
| InChI Key | FYGUSUBEMUKACF-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Hydroxypropyl Acrylate (mixture of 2-Hydroxypropyl and 2-Hydroxy-1-methylethyl Acrylate) 90.0+%, TCI America™
CAS: 25584-83-2 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD04113589 InChI Key: QZPSOSOOLFHYRR-UHFFFAOYSA-N Synonym: Acrylic Acid Hydroxypropyl Ester, Propylene Glycol Monoacrylate PubChem CID: 33101 IUPAC Name: 3-hydroxypropyl prop-2-enoate SMILES: C=CC(=O)OCCCO
| PubChem CID | 33101 |
|---|---|
| CAS | 25584-83-2 |
| Molecular Weight (g/mol) | 130.143 |
| MDL Number | MFCD04113589 |
| SMILES | C=CC(=O)OCCCO |
| Synonym | Acrylic Acid Hydroxypropyl Ester, Propylene Glycol Monoacrylate |
| IUPAC Name | 3-hydroxypropyl prop-2-enoate |
| InChI Key | QZPSOSOOLFHYRR-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |