Organic acids and derivatives
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Diethyl ethylidenemalonate, 99%
CAS: 1462-12-0 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00009145 InChI Key: LBBAWVLUOZVYCC-UHFFFAOYSA-N Synonym: diethyl ethylidenemalonate,diethyl 2-ethylidenemalonate,propanedioic acid, ethylidene-, diethyl ester,1,3-diethyl 2-ethylidenepropanedioate,2-ethylidenemalonic acid diethyl ester,diethylethylidenemalonate,acmc-1c0mi,diethyl ethylidene malonate,diethyl ethylidenepropanedioate,diethyl 2-ethylidenemalonate # PubChem CID: 73831 SMILES: CCOC(=O)C(=CC)C(=O)OCC
| PubChem CID | 73831 |
|---|---|
| CAS | 1462-12-0 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00009145 |
| SMILES | CCOC(=O)C(=CC)C(=O)OCC |
| Synonym | diethyl ethylidenemalonate,diethyl 2-ethylidenemalonate,propanedioic acid, ethylidene-, diethyl ester,1,3-diethyl 2-ethylidenepropanedioate,2-ethylidenemalonic acid diethyl ester,diethylethylidenemalonate,acmc-1c0mi,diethyl ethylidene malonate,diethyl ethylidenepropanedioate,diethyl 2-ethylidenemalonate # |
| InChI Key | LBBAWVLUOZVYCC-UHFFFAOYSA-N |
| Molecular Formula | C9H14O4 |
Ethylene glycol dimethacrylate, 98%, stab. with 100ppm 4-methoxyphenol
CAS: 97-90-5 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00008590 InChI Key: STVZJERGLQHEKB-UHFFFAOYSA-N Synonym: ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate PubChem CID: 7355 ChEBI: CHEBI:53436 IUPAC Name: 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCOC(=O)C(C)=C
| PubChem CID | 7355 |
|---|---|
| CAS | 97-90-5 |
| Molecular Weight (g/mol) | 198.22 |
| ChEBI | CHEBI:53436 |
| MDL Number | MFCD00008590 |
| SMILES | CC(=C)C(=O)OCCOC(=O)C(C)=C |
| Synonym | ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate |
| IUPAC Name | 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate |
| InChI Key | STVZJERGLQHEKB-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Methyl (S)-(-)-lactate, 97%
CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O
| PubChem CID | 94386 |
|---|---|
| CAS | 27871-49-4 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:83222 |
| MDL Number | MFCD00064265 |
| SMILES | COC(=O)[C@H](C)O |
| Synonym | methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester |
| IUPAC Name | methyl (2S)-2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-VKHMYHEASA-N |
| Molecular Formula | C4H8O3 |
Ethyl phenylpropiolate, 98%
CAS: 2216-94-6 Molecular Formula: C11H10O2 Molecular Weight (g/mol): 174.2 MDL Number: MFCD00009185 InChI Key: ACJOYTKWHPEIHW-UHFFFAOYSA-N Synonym: ethyl phenylpropiolate,ethylphenylpropiolate,ethyl 3-phenylpropiolate,ethyl phenylpropriolate,2-propynoic acid, 3-phenyl-, ethyl ester,ethyl 3-phenylpropynoate,ethyl phenylpropynoate,ethyl phenylacetylenecarboxylate,phenylpropiolic acid ethyl ester,ethyl 3-phenyl-2-propynoate PubChem CID: 91516 IUPAC Name: ethyl 3-phenylprop-2-ynoate SMILES: CCOC(=O)C#CC1=CC=CC=C1
| PubChem CID | 91516 |
|---|---|
| CAS | 2216-94-6 |
| Molecular Weight (g/mol) | 174.2 |
| MDL Number | MFCD00009185 |
| SMILES | CCOC(=O)C#CC1=CC=CC=C1 |
| Synonym | ethyl phenylpropiolate,ethylphenylpropiolate,ethyl 3-phenylpropiolate,ethyl phenylpropriolate,2-propynoic acid, 3-phenyl-, ethyl ester,ethyl 3-phenylpropynoate,ethyl phenylpropynoate,ethyl phenylacetylenecarboxylate,phenylpropiolic acid ethyl ester,ethyl 3-phenyl-2-propynoate |
| IUPAC Name | ethyl 3-phenylprop-2-ynoate |
| InChI Key | ACJOYTKWHPEIHW-UHFFFAOYSA-N |
| Molecular Formula | C11H10O2 |
Methyl 1-cyclohexene-1-carboxylate, 98%
CAS: 18448-47-0 MDL Number: MFCD00001544 InChI Key: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonym: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene PubChem CID: 87647 IUPAC Name: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1
| PubChem CID | 87647 |
|---|---|
| CAS | 18448-47-0 |
| MDL Number | MFCD00001544 |
| SMILES | COC(=O)C1=CCCCC1 |
| Synonym | methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene |
| IUPAC Name | methyl cyclohexene-1-carboxylate |
| InChI Key | KXPWRCPEMHIZGU-UHFFFAOYSA-N |
Methyl 2-methylbutyrate, 98%
CAS: 868-57-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009335 InChI Key: OCWLYWIFNDCWRZ-UHFFFAOYNA-N Synonym: methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate PubChem CID: 13357 IUPAC Name: methyl 2-methylbutanoate SMILES: CCC(C)C(=O)OC
| PubChem CID | 13357 |
|---|---|
| CAS | 868-57-5 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00009335 |
| SMILES | CCC(C)C(=O)OC |
| Synonym | methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate |
| IUPAC Name | methyl 2-methylbutanoate |
| InChI Key | OCWLYWIFNDCWRZ-UHFFFAOYNA-N |
| Molecular Formula | C6H12O2 |
Methyl DL-lactate, 99%
CAS: 547-64-8 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.105 MDL Number: MFCD00066367 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYSA-N Synonym: methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate PubChem CID: 11040 ChEBI: CHEBI:83221 IUPAC Name: methyl 2-hydroxypropanoate SMILES: CC(C(=O)OC)O
| PubChem CID | 11040 |
|---|---|
| CAS | 547-64-8 |
| Molecular Weight (g/mol) | 104.105 |
| ChEBI | CHEBI:83221 |
| MDL Number | MFCD00066367 |
| SMILES | CC(C(=O)OC)O |
| Synonym | methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate |
| IUPAC Name | methyl 2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Octyl 4-methoxycinnamate, 98%, stabilized
CAS: 5466-77-3 Molecular Formula: C18H26O3 Molecular Weight (g/mol): 290.40 MDL Number: MFCD00072582 InChI Key: YBGZDTIWKVFICR-UHFFFAOYNA-N Synonym: bidd:er0152,octyl methoxy cinnamate omc,unii-4y5p7mud51 component,2s-2-ethylhexyl 2e-3-4-methoxyphenyl prop-2-enoate PubChem CID: 11044481 IUPAC Name: [(2S)-2-ethylhexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate SMILES: CCCCC(CC)COC(=O)C=CC1=CC=C(OC)C=C1
| PubChem CID | 11044481 |
|---|---|
| CAS | 5466-77-3 |
| Molecular Weight (g/mol) | 290.40 |
| MDL Number | MFCD00072582 |
| SMILES | CCCCC(CC)COC(=O)C=CC1=CC=C(OC)C=C1 |
| Synonym | bidd:er0152,octyl methoxy cinnamate omc,unii-4y5p7mud51 component,2s-2-ethylhexyl 2e-3-4-methoxyphenyl prop-2-enoate |
| IUPAC Name | [(2S)-2-ethylhexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate |
| InChI Key | YBGZDTIWKVFICR-UHFFFAOYNA-N |
| Molecular Formula | C18H26O3 |
Methyl chloroacetate, 99+%
CAS: 96-34-4 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000931 InChI Key: QABLOFMHHSOFRJ-UHFFFAOYSA-N Synonym: methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 PubChem CID: 7295 IUPAC Name: methyl 2-chloroacetate SMILES: COC(=O)CCl
| PubChem CID | 7295 |
|---|---|
| CAS | 96-34-4 |
| Molecular Weight (g/mol) | 108.521 |
| MDL Number | MFCD00000931 |
| SMILES | COC(=O)CCl |
| Synonym | methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 |
| IUPAC Name | methyl 2-chloroacetate |
| InChI Key | QABLOFMHHSOFRJ-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO2 |
Methyl 2-oxo-2H-pyran-3-carboxylate, 98%
CAS: 25991-27-9 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.121 MDL Number: MFCD00075443 InChI Key: GJVZWOMUTYNUCE-UHFFFAOYSA-N Synonym: methyl 2-oxo-2h-pyran-3-carboxylate,3-carbomethoxy-2-pyrone,methyl 2-pyrone-3-carboxylate,2-oxo-2h-pyran-3-carboxylic acid methyl ester,2h-pyran-3-carboxylic acid, 2-oxo-, methyl ester,methoxycarbonyl pyranone,acmc-1clg5,ksc496k6b PubChem CID: 117704 IUPAC Name: methyl 2-oxopyran-3-carboxylate SMILES: COC(=O)C1=CC=COC1=O
| PubChem CID | 117704 |
|---|---|
| CAS | 25991-27-9 |
| Molecular Weight (g/mol) | 154.121 |
| MDL Number | MFCD00075443 |
| SMILES | COC(=O)C1=CC=COC1=O |
| Synonym | methyl 2-oxo-2h-pyran-3-carboxylate,3-carbomethoxy-2-pyrone,methyl 2-pyrone-3-carboxylate,2-oxo-2h-pyran-3-carboxylic acid methyl ester,2h-pyran-3-carboxylic acid, 2-oxo-, methyl ester,methoxycarbonyl pyranone,acmc-1clg5,ksc496k6b |
| IUPAC Name | methyl 2-oxopyran-3-carboxylate |
| InChI Key | GJVZWOMUTYNUCE-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
Methyl cinnamate, predominantly trans, 99%
CAS: 103-26-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00008458 InChI Key: CCRCUPLGCSFEDV-BQYQJAHWSA-N Synonym: methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate PubChem CID: 637520 ChEBI: CHEBI:6857 IUPAC Name: methyl (E)-3-phenylprop-2-enoate SMILES: COC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637520 |
|---|---|
| CAS | 103-26-4 |
| Molecular Weight (g/mol) | 162.188 |
| ChEBI | CHEBI:6857 |
| MDL Number | MFCD00008458 |
| SMILES | COC(=O)C=CC1=CC=CC=C1 |
| Synonym | methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate |
| IUPAC Name | methyl (E)-3-phenylprop-2-enoate |
| InChI Key | CCRCUPLGCSFEDV-BQYQJAHWSA-N |
| Molecular Formula | C10H10O2 |
Methyl p-toluate, 99%
CAS: 99-75-2 MDL Number: MFCD00008441 InChI Key: QSSJZLPUHJDYKF-UHFFFAOYSA-N Synonym: methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate PubChem CID: 7455 IUPAC Name: methyl 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC
| PubChem CID | 7455 |
|---|---|
| CAS | 99-75-2 |
| MDL Number | MFCD00008441 |
| SMILES | CC1=CC=C(C=C1)C(=O)OC |
| Synonym | methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate |
| IUPAC Name | methyl 4-methylbenzoate |
| InChI Key | QSSJZLPUHJDYKF-UHFFFAOYSA-N |
Methyl thioglycolate, 98%
CAS: 2365-48-2 Molecular Formula: C3H6O2S Molecular Weight (g/mol): 106.14 MDL Number: MFCD00004873 InChI Key: MKIJJIMOAABWGF-UHFFFAOYSA-N Synonym: methyl thioglycolate,methyl mercaptoacetate,methyl 2-mercaptoacetate,methylthioglycolate,thioglycolic acid methyl ester,acetic acid, mercapto-, methyl ester,methanethiol, methoxy,usaf ek-7119,thioglykolsaeure-methylester,unii-o1608la9el PubChem CID: 16907 IUPAC Name: methyl 2-sulfanylacetate SMILES: COC(=O)CS
| PubChem CID | 16907 |
|---|---|
| CAS | 2365-48-2 |
| Molecular Weight (g/mol) | 106.14 |
| MDL Number | MFCD00004873 |
| SMILES | COC(=O)CS |
| Synonym | methyl thioglycolate,methyl mercaptoacetate,methyl 2-mercaptoacetate,methylthioglycolate,thioglycolic acid methyl ester,acetic acid, mercapto-, methyl ester,methanethiol, methoxy,usaf ek-7119,thioglykolsaeure-methylester,unii-o1608la9el |
| IUPAC Name | methyl 2-sulfanylacetate |
| InChI Key | MKIJJIMOAABWGF-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2S |
Ethyl methacrylate, 99%, stabilized
CAS: 97-63-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00009161 InChI Key: SUPCQIBBMFXVTL-UHFFFAOYSA-N Synonym: ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester PubChem CID: 7343 IUPAC Name: ethyl 2-methylprop-2-enoate SMILES: CCOC(=O)C(=C)C
| PubChem CID | 7343 |
|---|---|
| CAS | 97-63-2 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00009161 |
| SMILES | CCOC(=O)C(=C)C |
| Synonym | ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester |
| IUPAC Name | ethyl 2-methylprop-2-enoate |
| InChI Key | SUPCQIBBMFXVTL-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Methyl trifluoroacetate, 99%
CAS: 431-47-0 Molecular Formula: C3H3F3O2 Molecular Weight (g/mol): 128.05 MDL Number: MFCD00000417 InChI Key: VMVNZNXAVJHNDJ-UHFFFAOYSA-N Synonym: methyl trifluoroacetate,trifluoroacetic acid methyl ester,acetic acid, trifluoro-, methyl ester,methyltrifluoroacetate,2,2,2-trifluoromethylacetate,acetic acid, 2,2,2-trifluoro-, methyl ester,methyl trifluoracetate,tfamt,methyl triflouroacetate,pubchem12490 PubChem CID: 9893 IUPAC Name: methyl 2,2,2-trifluoroacetate SMILES: COC(=O)C(F)(F)F
| PubChem CID | 9893 |
|---|---|
| CAS | 431-47-0 |
| Molecular Weight (g/mol) | 128.05 |
| MDL Number | MFCD00000417 |
| SMILES | COC(=O)C(F)(F)F |
| Synonym | methyl trifluoroacetate,trifluoroacetic acid methyl ester,acetic acid, trifluoro-, methyl ester,methyltrifluoroacetate,2,2,2-trifluoromethylacetate,acetic acid, 2,2,2-trifluoro-, methyl ester,methyl trifluoracetate,tfamt,methyl triflouroacetate,pubchem12490 |
| IUPAC Name | methyl 2,2,2-trifluoroacetate |
| InChI Key | VMVNZNXAVJHNDJ-UHFFFAOYSA-N |
| Molecular Formula | C3H3F3O2 |