Organic acids and derivatives
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Vinyl benzoate, 95%
CAS: 769-78-8 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00048141 InChI Key: KOZCZZVUFDCZGG-UHFFFAOYSA-N Synonym: vinyl benzoate,benzoic acid vinyl ester,benzoic acid, ethenyl ester,benzoic acid, vinyl ester,unii-f1e7c1ggku,vinylester kyseliny benzoove,vinylester kyseliny benzoove czech,f1e7c1ggku,benzoic acid, ethenyl ester 9ci,benzoic acid vinyl PubChem CID: 13037 ChEBI: CHEBI:84279 IUPAC Name: ethenyl benzoate SMILES: C=COC(=O)C1=CC=CC=C1
| PubChem CID | 13037 |
|---|---|
| CAS | 769-78-8 |
| Molecular Weight (g/mol) | 148.161 |
| ChEBI | CHEBI:84279 |
| MDL Number | MFCD00048141 |
| SMILES | C=COC(=O)C1=CC=CC=C1 |
| Synonym | vinyl benzoate,benzoic acid vinyl ester,benzoic acid, ethenyl ester,benzoic acid, vinyl ester,unii-f1e7c1ggku,vinylester kyseliny benzoove,vinylester kyseliny benzoove czech,f1e7c1ggku,benzoic acid, ethenyl ester 9ci,benzoic acid vinyl |
| IUPAC Name | ethenyl benzoate |
| InChI Key | KOZCZZVUFDCZGG-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
Methyl 4-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™
CAS: 190660-97-0 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.30 MDL Number: MFCD06203847 InChI Key: SRXQDDFKGDLAJM-UHFFFAOYSA-N Synonym: methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate PubChem CID: 18508114 IUPAC Name: methyl 4-[3-(dimethylamino)propoxy]benzoate SMILES: COC(=O)C1=CC=C(OCCCN(C)C)C=C1
| PubChem CID | 18508114 |
|---|---|
| CAS | 190660-97-0 |
| Molecular Weight (g/mol) | 237.30 |
| MDL Number | MFCD06203847 |
| SMILES | COC(=O)C1=CC=C(OCCCN(C)C)C=C1 |
| Synonym | methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate |
| IUPAC Name | methyl 4-[3-(dimethylamino)propoxy]benzoate |
| InChI Key | SRXQDDFKGDLAJM-UHFFFAOYSA-N |
| Molecular Formula | C13H19NO3 |
2,2,3,3,3-Pentafluoropropyl methacrylate, 97%, stab.
CAS: 45115-53-5 Molecular Formula: C7H7F5O2 Molecular Weight (g/mol): 218.123 MDL Number: MFCD00039256 InChI Key: CLISWDZSTWQFNX-UHFFFAOYSA-N Synonym: 1h,1h-pentafluoropropyl methacrylate,2,2,3,3,3-pentafluoropropyl methacrylate,2-propenoic acid, 2-methyl-, 2,2,3,3,3-pentafluoropropyl ester,1h,1h-pentafluoro-n-propyl methacrylate,2,2,3,3,3-pentafluoro-n-propyl methacrylate,methacrylic acid 2,2,3,3,3-pentafluoropropyl ester,2,2,3,3,3-pentafluoropropyl methacrylate stabilized with tbc,2,2,3,3,3-pentafluoropropyl methacrylate, contains 100 ppm 4-tert-butylcatechol as inhibitor PubChem CID: 123516 IUPAC Name: 2,2,3,3,3-pentafluoropropyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC(C(F)(F)F)(F)F
| PubChem CID | 123516 |
|---|---|
| CAS | 45115-53-5 |
| Molecular Weight (g/mol) | 218.123 |
| MDL Number | MFCD00039256 |
| SMILES | CC(=C)C(=O)OCC(C(F)(F)F)(F)F |
| Synonym | 1h,1h-pentafluoropropyl methacrylate,2,2,3,3,3-pentafluoropropyl methacrylate,2-propenoic acid, 2-methyl-, 2,2,3,3,3-pentafluoropropyl ester,1h,1h-pentafluoro-n-propyl methacrylate,2,2,3,3,3-pentafluoro-n-propyl methacrylate,methacrylic acid 2,2,3,3,3-pentafluoropropyl ester,2,2,3,3,3-pentafluoropropyl methacrylate stabilized with tbc,2,2,3,3,3-pentafluoropropyl methacrylate, contains 100 ppm 4-tert-butylcatechol as inhibitor |
| IUPAC Name | 2,2,3,3,3-pentafluoropropyl 2-methylprop-2-enoate |
| InChI Key | CLISWDZSTWQFNX-UHFFFAOYSA-N |
| Molecular Formula | C7H7F5O2 |
Methyl 3-cyclopentenecarboxylate, 97%, Thermo Scientific Chemicals
CAS: 58101-60-3 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD04038661 InChI Key: CEOILRYKIJRPBZ-UHFFFAOYSA-N Synonym: methyl 3-cyclopentenecarboxylate,methyl cyclopent-3-enecarboxylate,methyl-3-cyclopentene-1-carboxylate,methyl3-cyclopentenecarboxylate,3-cyclopentene-1-carboxylic acid methyl ester,3-cyclopentene-1-carboxylic acid, methyl ester,acmc-209m2j,methyl cyclopent-3-ene carboxylate,4-methoxycarbonyl cyclopent-1-ene,methyl 3-cyclopentene-1-carboxylate PubChem CID: 1514118 IUPAC Name: methyl cyclopent-3-ene-1-carboxylate SMILES: COC(=O)C1CC=CC1
| PubChem CID | 1514118 |
|---|---|
| CAS | 58101-60-3 |
| Molecular Weight (g/mol) | 126.16 |
| MDL Number | MFCD04038661 |
| SMILES | COC(=O)C1CC=CC1 |
| Synonym | methyl 3-cyclopentenecarboxylate,methyl cyclopent-3-enecarboxylate,methyl-3-cyclopentene-1-carboxylate,methyl3-cyclopentenecarboxylate,3-cyclopentene-1-carboxylic acid methyl ester,3-cyclopentene-1-carboxylic acid, methyl ester,acmc-209m2j,methyl cyclopent-3-ene carboxylate,4-methoxycarbonyl cyclopent-1-ene,methyl 3-cyclopentene-1-carboxylate |
| IUPAC Name | methyl cyclopent-3-ene-1-carboxylate |
| InChI Key | CEOILRYKIJRPBZ-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |
Methyl 3,3-dimethoxypropionate, 96%
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.158 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N PubChem CID: 81924 IUPAC Name: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC
| PubChem CID | 81924 |
|---|---|
| CAS | 7424-91-1 |
| Molecular Weight (g/mol) | 148.158 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |
Methyl glycolate, 98%
CAS: 96-35-5 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.078 MDL Number: MFCD00004667 InChI Key: GSJFXBNYJCXDGI-UHFFFAOYSA-N Synonym: methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate PubChem CID: 66774 IUPAC Name: methyl 2-hydroxyacetate SMILES: COC(=O)CO
| PubChem CID | 66774 |
|---|---|
| CAS | 96-35-5 |
| Molecular Weight (g/mol) | 90.078 |
| MDL Number | MFCD00004667 |
| SMILES | COC(=O)CO |
| Synonym | methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate |
| IUPAC Name | methyl 2-hydroxyacetate |
| InChI Key | GSJFXBNYJCXDGI-UHFFFAOYSA-N |
| Molecular Formula | C3H6O3 |
Benzyl cinnamate, 99%
CAS: 103-41-3 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.29 MDL Number: MFCD00004789,MFCD00004789,MFCD00004789 InChI Key: NGHOLYJTSCBCGC-VAWYXSNFSA-N Synonym: benzyl alcohol cinnamic ester,benzylcinnamate,benzyl alcohol, cinnamate,wln: r1u1vo1r,benzyl .gamma.-phenylacrylate,benzyl cis-cinnamate,benzyl z-cinnamate,2-propenoic acid, 3-phenyl-, phenylmethyl ester,z-benzyl 3-phenylacrylate,cinnamic acid, benzyl ester, z PubChem CID: 15558051 IUPAC Name: benzyl (Z)-3-phenylprop-2-enoate SMILES: O=C(OCC1=CC=CC=C1)\C=C\C1=CC=CC=C1
| PubChem CID | 15558051 |
|---|---|
| CAS | 103-41-3 |
| Molecular Weight (g/mol) | 238.29 |
| MDL Number | MFCD00004789,MFCD00004789,MFCD00004789 |
| SMILES | O=C(OCC1=CC=CC=C1)\C=C\C1=CC=CC=C1 |
| Synonym | benzyl alcohol cinnamic ester,benzylcinnamate,benzyl alcohol, cinnamate,wln: r1u1vo1r,benzyl .gamma.-phenylacrylate,benzyl cis-cinnamate,benzyl z-cinnamate,2-propenoic acid, 3-phenyl-, phenylmethyl ester,z-benzyl 3-phenylacrylate,cinnamic acid, benzyl ester, z |
| IUPAC Name | benzyl (Z)-3-phenylprop-2-enoate |
| InChI Key | NGHOLYJTSCBCGC-VAWYXSNFSA-N |
| Molecular Formula | C16H14O2 |
Methyl 2,6-dichlorophenylacetate, 99%
CAS: 54551-83-6 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.07 MDL Number: MFCD00191640 InChI Key: FCWRUYPZZJPCCG-UHFFFAOYSA-N Synonym: methyl 2,6-dichlorophenylacetate,methyl 2-2,6-dichlorophenyl acetate,2,6-dichlorophenylacetic acid methyl ester,benzeneacetic acid,2,6-dichloro-, methyl ester,benzeneacetic acid, 2,6-dichloro-, methyl ester,acmc-209lhf,methyl2,6-dichlorophenylacetate,guanfacine methyl ester impurity,methyl 2,6-dichlorophenyl acetate,2,6-dichloro-phenylacetic acid methyl ester PubChem CID: 2734107 IUPAC Name: methyl 2-(2,6-dichlorophenyl)acetate SMILES: COC(=O)CC1=C(C=CC=C1Cl)Cl
| PubChem CID | 2734107 |
|---|---|
| CAS | 54551-83-6 |
| Molecular Weight (g/mol) | 219.07 |
| MDL Number | MFCD00191640 |
| SMILES | COC(=O)CC1=C(C=CC=C1Cl)Cl |
| Synonym | methyl 2,6-dichlorophenylacetate,methyl 2-2,6-dichlorophenyl acetate,2,6-dichlorophenylacetic acid methyl ester,benzeneacetic acid,2,6-dichloro-, methyl ester,benzeneacetic acid, 2,6-dichloro-, methyl ester,acmc-209lhf,methyl2,6-dichlorophenylacetate,guanfacine methyl ester impurity,methyl 2,6-dichlorophenyl acetate,2,6-dichloro-phenylacetic acid methyl ester |
| IUPAC Name | methyl 2-(2,6-dichlorophenyl)acetate |
| InChI Key | FCWRUYPZZJPCCG-UHFFFAOYSA-N |
| Molecular Formula | C9H8Cl2O2 |
Methyl crotonate, 96%, trans-isomer
CAS: 623-43-8 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00009287 InChI Key: MCVVUJPXSBQTRZ-ONEGZZNKSA-N Synonym: methyl crotonate,e-methyl but-2-enoate,trans-methyl crotonate,methyl e-crotonate,methyl 2-butenoate,methyl trans-crotonate,2-butenoic acid, methyl ester, 2e,trans-2-butenoic acid methyl ester,methyl trans-2-butenoate,e-crotonic acid methyl ester PubChem CID: 638132 IUPAC Name: methyl (E)-but-2-enoate SMILES: COC(=O)\C=C\C
| PubChem CID | 638132 |
|---|---|
| CAS | 623-43-8 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00009287 |
| SMILES | COC(=O)\C=C\C |
| Synonym | methyl crotonate,e-methyl but-2-enoate,trans-methyl crotonate,methyl e-crotonate,methyl 2-butenoate,methyl trans-crotonate,2-butenoic acid, methyl ester, 2e,trans-2-butenoic acid methyl ester,methyl trans-2-butenoate,e-crotonic acid methyl ester |
| IUPAC Name | methyl (E)-but-2-enoate |
| InChI Key | MCVVUJPXSBQTRZ-ONEGZZNKSA-N |
| Molecular Formula | C5H8O2 |
Benzyl methacrylate, 98%, stab. with ca 50-100ppm 4-methoxyphenol
CAS: 2495-37-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.215 MDL Number: MFCD00053684 InChI Key: AOJOEFVRHOZDFN-UHFFFAOYSA-N Synonym: benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl PubChem CID: 17236 IUPAC Name: benzyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC1=CC=CC=C1
| PubChem CID | 17236 |
|---|---|
| CAS | 2495-37-6 |
| Molecular Weight (g/mol) | 176.215 |
| MDL Number | MFCD00053684 |
| SMILES | CC(=C)C(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl |
| IUPAC Name | benzyl 2-methylprop-2-enoate |
| InChI Key | AOJOEFVRHOZDFN-UHFFFAOYSA-N |
| Molecular Formula | C11H12O2 |
Methyl 2-butynoate, 97%
CAS: 23326-27-4 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.1 MDL Number: MFCD00009273 InChI Key: UJQCANQILFWSDJ-UHFFFAOYSA-N Synonym: methyl 2-butynoate,methyl tetrolate,2-butynoic acid, methyl ester,2-butynoic acid methyl ester,tetrolic acid methyl ester,but-2-ynoic acid methyl ester,methyl2-butynoate,methyl 2-butynoate ?,pubchem12783,acmc-1ceil PubChem CID: 141019 IUPAC Name: methyl but-2-ynoate SMILES: CC#CC(=O)OC
| PubChem CID | 141019 |
|---|---|
| CAS | 23326-27-4 |
| Molecular Weight (g/mol) | 98.1 |
| MDL Number | MFCD00009273 |
| SMILES | CC#CC(=O)OC |
| Synonym | methyl 2-butynoate,methyl tetrolate,2-butynoic acid, methyl ester,2-butynoic acid methyl ester,tetrolic acid methyl ester,but-2-ynoic acid methyl ester,methyl2-butynoate,methyl 2-butynoate ?,pubchem12783,acmc-1ceil |
| IUPAC Name | methyl but-2-ynoate |
| InChI Key | UJQCANQILFWSDJ-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
Ethyl cinnamate, 98% trans
CAS: 103-36-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.21 InChI Key: KBEBGUQPQBELIU-CMDGGOBGSA-N Synonym: ethyl cinnamate,ethyl 3-phenylacrylate,ethylcinnamate,cinnamic acid ethyl ester,ethylcinnamoate,cinnamic acid, ethyl ester,ethyl trans-cinnamate,e-ethyl cinnamate,ethyl 3-phenyl-2-propenoate,ethyl benzylideneacetate PubChem CID: 637758 ChEBI: CHEBI:4895 IUPAC Name: ethyl (E)-3-phenylprop-2-enoate SMILES: CCOC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637758 |
|---|---|
| CAS | 103-36-6 |
| Molecular Weight (g/mol) | 176.21 |
| ChEBI | CHEBI:4895 |
| SMILES | CCOC(=O)C=CC1=CC=CC=C1 |
| Synonym | ethyl cinnamate,ethyl 3-phenylacrylate,ethylcinnamate,cinnamic acid ethyl ester,ethylcinnamoate,cinnamic acid, ethyl ester,ethyl trans-cinnamate,e-ethyl cinnamate,ethyl 3-phenyl-2-propenoate,ethyl benzylideneacetate |
| IUPAC Name | ethyl (E)-3-phenylprop-2-enoate |
| InChI Key | KBEBGUQPQBELIU-CMDGGOBGSA-N |
| Molecular Formula | C11H12O2 |
Sodium Ascorbate, FCC, 99-101%, Spectrum™ Chemical
CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
| CAS | 134-03-2 |
|---|---|
| Molecular Weight (g/mol) | 198.11 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
(+)-Dimethyl 2,3-O-isopropylidene-D-tartrate, 97%
CAS: 37031-30-4 Molecular Formula: C9H14O6 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00040504 InChI Key: ROZOUYVVWUTPNG-WDSKDSINSA-N Synonym: 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester,+-dimethyl 2,3-o-isopropylidene-d-tartrate,dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4s,5s-dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4,5-dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,pubchem6765,dimethyl--2,3-o-isopropylidene-l-tartrate,dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #,+-dimethyl-2,3-o-isopropylidine-d-tartrate,dimethyl +-2,3-o-isopropylidene-d-tartrate PubChem CID: 688156 IUPAC Name: dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate SMILES: CC1(OC(C(O1)C(=O)OC)C(=O)OC)C
| PubChem CID | 688156 |
|---|---|
| CAS | 37031-30-4 |
| Molecular Weight (g/mol) | 218.21 |
| MDL Number | MFCD00040504 |
| SMILES | CC1(OC(C(O1)C(=O)OC)C(=O)OC)C |
| Synonym | 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester,+-dimethyl 2,3-o-isopropylidene-d-tartrate,dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4s,5s-dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4,5-dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,pubchem6765,dimethyl--2,3-o-isopropylidene-l-tartrate,dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #,+-dimethyl-2,3-o-isopropylidine-d-tartrate,dimethyl +-2,3-o-isopropylidene-d-tartrate |
| IUPAC Name | dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate |
| InChI Key | ROZOUYVVWUTPNG-WDSKDSINSA-N |
| Molecular Formula | C9H14O6 |
Methyl trans-2-pentenoate, 95%
CAS: 15790-88-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00137611 InChI Key: MBAHGFJTIVZLFB-SNAWJCMRSA-N Synonym: methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate PubChem CID: 5364718 SMILES: CC\C=C\C(=O)OC
| PubChem CID | 5364718 |
|---|---|
| CAS | 15790-88-2 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00137611 |
| SMILES | CC\C=C\C(=O)OC |
| Synonym | methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate |
| InChI Key | MBAHGFJTIVZLFB-SNAWJCMRSA-N |
| Molecular Formula | C6H10O2 |