Organic acids and derivatives
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1-(Trifluoromethyl)vinyl acetate, 97%
CAS: 2247-91-8 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.088 MDL Number: MFCD00040844 InChI Key: VOKGSDIHTCTXDS-UHFFFAOYSA-N Synonym: 1-trifluoromethyl vinyl acetate,1-trifluoromethyl ethenyl acetate,1-propen-2-ol, 3,3,3-trifluoro-, acetate,1-propen-2-ol, 3,3,3-trifluoro-, 2-acetate,trifluoroacetone enol acetate,trifluoroacetone enolacetate,alpha-trifluoromethylvinyl acetate,acmc-1cjli,3,3,3-trifluoropropen-2-yl acetate,alpa-trifluoromethyl vinyl acetate PubChem CID: 75254 IUPAC Name: 3,3,3-trifluoroprop-1-en-2-yl acetate SMILES: CC(=O)OC(=C)C(F)(F)F
| PubChem CID | 75254 |
|---|---|
| CAS | 2247-91-8 |
| Molecular Weight (g/mol) | 154.088 |
| MDL Number | MFCD00040844 |
| SMILES | CC(=O)OC(=C)C(F)(F)F |
| Synonym | 1-trifluoromethyl vinyl acetate,1-trifluoromethyl ethenyl acetate,1-propen-2-ol, 3,3,3-trifluoro-, acetate,1-propen-2-ol, 3,3,3-trifluoro-, 2-acetate,trifluoroacetone enol acetate,trifluoroacetone enolacetate,alpha-trifluoromethylvinyl acetate,acmc-1cjli,3,3,3-trifluoropropen-2-yl acetate,alpa-trifluoromethyl vinyl acetate |
| IUPAC Name | 3,3,3-trifluoroprop-1-en-2-yl acetate |
| InChI Key | VOKGSDIHTCTXDS-UHFFFAOYSA-N |
| Molecular Formula | C5H5F3O2 |
Methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate, 97%, Thermo Scientific™
CAS: 209912-44-7 Molecular Formula: C11H10N2O3 Molecular Weight (g/mol): 218.212 MDL Number: MFCD08690288 InChI Key: PJYMNVKGDLTDJE-UHFFFAOYSA-N Synonym: methyl 4-3-methyl-1,2,4-oxadiazol-5-yl benzoate,4-3-methyl-1,2,4-oxadiazole-5-yl benzoic acid methyl ester,benzoicacid, 4-3-methyl-1,2,4-oxadiazol-5-yl-, methyl ester PubChem CID: 11096067 IUPAC Name: methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)C(=O)OC
| PubChem CID | 11096067 |
|---|---|
| CAS | 209912-44-7 |
| Molecular Weight (g/mol) | 218.212 |
| MDL Number | MFCD08690288 |
| SMILES | CC1=NOC(=N1)C2=CC=C(C=C2)C(=O)OC |
| Synonym | methyl 4-3-methyl-1,2,4-oxadiazol-5-yl benzoate,4-3-methyl-1,2,4-oxadiazole-5-yl benzoic acid methyl ester,benzoicacid, 4-3-methyl-1,2,4-oxadiazol-5-yl-, methyl ester |
| IUPAC Name | methyl 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate |
| InChI Key | PJYMNVKGDLTDJE-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O3 |
Methyl dichloroacetate, 99%
CAS: 116-54-1 Molecular Formula: C3H4Cl2O2 Molecular Weight (g/mol): 142.97 MDL Number: MFCD00000843 InChI Key: HKMLRUAPIDAGIE-UHFFFAOYSA-N Synonym: methyl dichloroacetate,dichloroacetic acid methyl ester,acetic acid, dichloro-, methyl ester,ccris 7740,acetic acid, 2,2-dichloro-, methyl ester,methyldichloroethanoate,acmc-1brpm,dichloroacetic acid methyl,methyl2,2-dichloroacetate,wln: gygvo1 PubChem CID: 8315 IUPAC Name: methyl 2,2-dichloroacetate SMILES: COC(=O)C(Cl)Cl
| PubChem CID | 8315 |
|---|---|
| CAS | 116-54-1 |
| Molecular Weight (g/mol) | 142.97 |
| MDL Number | MFCD00000843 |
| SMILES | COC(=O)C(Cl)Cl |
| Synonym | methyl dichloroacetate,dichloroacetic acid methyl ester,acetic acid, dichloro-, methyl ester,ccris 7740,acetic acid, 2,2-dichloro-, methyl ester,methyldichloroethanoate,acmc-1brpm,dichloroacetic acid methyl,methyl2,2-dichloroacetate,wln: gygvo1 |
| IUPAC Name | methyl 2,2-dichloroacetate |
| InChI Key | HKMLRUAPIDAGIE-UHFFFAOYSA-N |
| Molecular Formula | C3H4Cl2O2 |
Methyl phenylpropiolate, 98%
CAS: 4891-38-7 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00041685 InChI Key: JFGWPXKGINUNDH-UHFFFAOYSA-N Synonym: methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate PubChem CID: 138378 IUPAC Name: methyl 3-phenylprop-2-ynoate SMILES: COC(=O)C#CC1=CC=CC=C1
| PubChem CID | 138378 |
|---|---|
| CAS | 4891-38-7 |
| Molecular Weight (g/mol) | 160.17 |
| MDL Number | MFCD00041685 |
| SMILES | COC(=O)C#CC1=CC=CC=C1 |
| Synonym | methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate |
| IUPAC Name | methyl 3-phenylprop-2-ynoate |
| InChI Key | JFGWPXKGINUNDH-UHFFFAOYSA-N |
| Molecular Formula | C10H8O2 |
Methyl 3,3-dimethoxypropionate, 99%
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N Synonym: methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa 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) | 148.16 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| Synonym | methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |
Methyl bromoacetate, 99%
CAS: 96-32-2 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.98 MDL Number: MFCD00000189 InChI Key: YDCHPLOFQATIDS-UHFFFAOYSA-N Synonym: methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech PubChem CID: 60984 IUPAC Name: methyl 2-bromoacetate SMILES: COC(=O)CBr
| PubChem CID | 60984 |
|---|---|
| CAS | 96-32-2 |
| Molecular Weight (g/mol) | 152.98 |
| MDL Number | MFCD00000189 |
| SMILES | COC(=O)CBr |
| Synonym | methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech |
| IUPAC Name | methyl 2-bromoacetate |
| InChI Key | YDCHPLOFQATIDS-UHFFFAOYSA-N |
| Molecular Formula | C3H5BrO2 |
Dibutyl maleate, 97%
CAS: 105-76-0 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00009447,MFCD00065141 InChI Key: JBSLOWBPDRZSMB-FPLPWBNLSA-N Synonym: dibutyl maleate,butyl maleate,staflex dbm,rc comonomer dbm,maleic acid, dibutyl ester,di-n-butyl maleate,2-butenedioic acid z-, dibutyl ester,2-butenedioic acid, dibutyl ester,maleic acid dibutyl ester,2-butenedioic acid 2z-, dibutyl ester PubChem CID: 5271569 IUPAC Name: dibutyl (Z)-but-2-enedioate SMILES: CCCCOC(=O)\C=C/C(=O)OCCCC
| PubChem CID | 5271569 |
|---|---|
| CAS | 105-76-0 |
| Molecular Weight (g/mol) | 228.29 |
| MDL Number | MFCD00009447,MFCD00065141 |
| SMILES | CCCCOC(=O)\C=C/C(=O)OCCCC |
| Synonym | dibutyl maleate,butyl maleate,staflex dbm,rc comonomer dbm,maleic acid, dibutyl ester,di-n-butyl maleate,2-butenedioic acid z-, dibutyl ester,2-butenedioic acid, dibutyl ester,maleic acid dibutyl ester,2-butenedioic acid 2z-, dibutyl ester |
| IUPAC Name | dibutyl (Z)-but-2-enedioate |
| InChI Key | JBSLOWBPDRZSMB-FPLPWBNLSA-N |
| Molecular Formula | C12H20O4 |
Ethyl 2-butynoate, 98%
CAS: 4341-76-8 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00015182 InChI Key: FCJJZKCJURDYNF-UHFFFAOYSA-N Synonym: ethyl 2-butynoate,ethyl tetrolate,2-butynoic acid ethyl ester,but-2-ynoic acid ethyl ester,2-butynoic acid, ethyl ester,tetrolic acid ethyl ester,ethyl-2-butynoate,ethyl 3-methylpropiolate,acmc-1aeo2,ethyl 1-propynecarboxylate PubChem CID: 78043 IUPAC Name: ethyl but-2-ynoate SMILES: CCOC(=O)C#CC
| PubChem CID | 78043 |
|---|---|
| CAS | 4341-76-8 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD00015182 |
| SMILES | CCOC(=O)C#CC |
| Synonym | ethyl 2-butynoate,ethyl tetrolate,2-butynoic acid ethyl ester,but-2-ynoic acid ethyl ester,2-butynoic acid, ethyl ester,tetrolic acid ethyl ester,ethyl-2-butynoate,ethyl 3-methylpropiolate,acmc-1aeo2,ethyl 1-propynecarboxylate |
| IUPAC Name | ethyl but-2-ynoate |
| InChI Key | FCJJZKCJURDYNF-UHFFFAOYSA-N |
| Molecular Formula | C6H8O2 |
Methyl DL-lactate, 99%
CAS: 547-64-8 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 |
| 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 |
MilliporeSigma™ Dihydrorhodamine 123, Calbiochem™,
CAS: 109244-58-8 Molecular Formula: C21H18N2O3 Molecular Weight (g/mol): 346.39 MDL Number: MFCD04221428 InChI Key: FNEZBBILNYNQGC-UHFFFAOYSA-N Synonym: dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 PubChem CID: 105032 IUPAC Name: methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate SMILES: COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12
| PubChem CID | 105032 |
|---|---|
| CAS | 109244-58-8 |
| Molecular Weight (g/mol) | 346.39 |
| MDL Number | MFCD04221428 |
| SMILES | COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12 |
| Synonym | dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 |
| IUPAC Name | methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate |
| InChI Key | FNEZBBILNYNQGC-UHFFFAOYSA-N |
| Molecular Formula | C21H18N2O3 |
Diethyl maleate, 97%
CAS: 141-05-9 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00009191 InChI Key: IEPRKVQEAMIZSS-WAYWQWQTSA-N Synonym: diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941 PubChem CID: 5271566 ChEBI: CHEBI:68508 IUPAC Name: diethyl (Z)-but-2-enedioate SMILES: CCOC(=O)C=CC(=O)OCC
| PubChem CID | 5271566 |
|---|---|
| CAS | 141-05-9 |
| Molecular Weight (g/mol) | 172.18 |
| ChEBI | CHEBI:68508 |
| MDL Number | MFCD00009191 |
| SMILES | CCOC(=O)C=CC(=O)OCC |
| Synonym | diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941 |
| IUPAC Name | diethyl (Z)-but-2-enedioate |
| InChI Key | IEPRKVQEAMIZSS-WAYWQWQTSA-N |
Methyl phenylpropiolate, 97%
CAS: 4891-38-7 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.172 MDL Number: MFCD00041685 InChI Key: JFGWPXKGINUNDH-UHFFFAOYSA-N Synonym: methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate PubChem CID: 138378 IUPAC Name: methyl 3-phenylprop-2-ynoate SMILES: COC(=O)C#CC1=CC=CC=C1
| PubChem CID | 138378 |
|---|---|
| CAS | 4891-38-7 |
| Molecular Weight (g/mol) | 160.172 |
| MDL Number | MFCD00041685 |
| SMILES | COC(=O)C#CC1=CC=CC=C1 |
| Synonym | methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate |
| IUPAC Name | methyl 3-phenylprop-2-ynoate |
| InChI Key | JFGWPXKGINUNDH-UHFFFAOYSA-N |
| Molecular Formula | C10H8O2 |
Methyl trans-2-hexenoate, 97%
CAS: 13894-63-8 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00048798 InChI Key: GFUGBRNILVVWIE-AATRIKPKSA-N Synonym: methyl 2-hexenoate,methyl e-2-hexenoate,methyl trans-2-hexenoate,methyl e-hex-2-enoate,methyl 2e-hexenoate,methyl 2e-hex-2-enoate,2-hexenoic acid, methyl ester, e,methyl 2e-2-hexenoate,2e-2-hexenoic acid methyl ester,unii-x2ddu82182 PubChem CID: 5364409 IUPAC Name: methyl (E)-hex-2-enoate SMILES: CCCC=CC(=O)OC
| PubChem CID | 5364409 |
|---|---|
| CAS | 13894-63-8 |
| Molecular Weight (g/mol) | 128.171 |
| MDL Number | MFCD00048798 |
| SMILES | CCCC=CC(=O)OC |
| Synonym | methyl 2-hexenoate,methyl e-2-hexenoate,methyl trans-2-hexenoate,methyl e-hex-2-enoate,methyl 2e-hexenoate,methyl 2e-hex-2-enoate,2-hexenoic acid, methyl ester, e,methyl 2e-2-hexenoate,2e-2-hexenoic acid methyl ester,unii-x2ddu82182 |
| IUPAC Name | methyl (E)-hex-2-enoate |
| InChI Key | GFUGBRNILVVWIE-AATRIKPKSA-N |
| Molecular Formula | C7H12O2 |
Isopropenyl acetate, 99%
CAS: 108-22-5 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008709 InChI Key: HETCEOQFVDFGSY-UHFFFAOYSA-N Synonym: isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate PubChem CID: 7916 IUPAC Name: prop-1-en-2-yl acetate SMILES: CC(=C)OC(C)=O
| PubChem CID | 7916 |
|---|---|
| CAS | 108-22-5 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00008709 |
| SMILES | CC(=C)OC(C)=O |
| Synonym | isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate |
| IUPAC Name | prop-1-en-2-yl acetate |
| InChI Key | HETCEOQFVDFGSY-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
1,1-Cyclopropanedicarboxylic acid monomethyl ester, 97%
CAS: 113020-21-6 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD06800496 InChI Key: IZYOHLOUZVEIOS-UHFFFAOYSA-N Synonym: 1-methoxycarbonyl cyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid monomethyl ester,1-methoxycarbonyl cyclopropane-1-carboxylic acid,cyclopropane-1,1-dicarboxylic acid, methyl ester,1-methoxycarbonylcyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid-1-methyl ester,1-methoxycarbonyl cyclopropanecarboxylicacid,acmc-1c7y7,methyl cyclopropane-1,1-dicarboxylate,1-methoxycarbonylcyclopropane carboxylic acid PubChem CID: 13861823 IUPAC Name: 1-methoxycarbonylcyclopropane-1-carboxylic acid SMILES: COC(=O)C1(CC1)C(=O)O
| PubChem CID | 13861823 |
|---|---|
| CAS | 113020-21-6 |
| Molecular Weight (g/mol) | 144.126 |
| MDL Number | MFCD06800496 |
| SMILES | COC(=O)C1(CC1)C(=O)O |
| Synonym | 1-methoxycarbonyl cyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid monomethyl ester,1-methoxycarbonyl cyclopropane-1-carboxylic acid,cyclopropane-1,1-dicarboxylic acid, methyl ester,1-methoxycarbonylcyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid-1-methyl ester,1-methoxycarbonyl cyclopropanecarboxylicacid,acmc-1c7y7,methyl cyclopropane-1,1-dicarboxylate,1-methoxycarbonylcyclopropane carboxylic acid |
| IUPAC Name | 1-methoxycarbonylcyclopropane-1-carboxylic acid |
| InChI Key | IZYOHLOUZVEIOS-UHFFFAOYSA-N |
| Molecular Formula | C6H8O4 |