Carboxylic acids and derivatives
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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 |
N-Ethylphthalimide, 98%, Thermo Scientific Chemicals
CAS: 5022-29-7 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00014583 InChI Key: JZDSOQSUCWVBMV-UHFFFAOYSA-N Synonym: n-ethylphthalimide,2-ethylisoindoline-1,3-dione,phthalimide, n-ethyl,1h-isoindole-1,3 2h-dione, 2-ethyl,2-ethyl-1h-isoindole-1,3 2h-dione,1h-isoindole-1,3 2h-dione, n-ethyl,2-ethylbenzo c azoline-1,3-dione,acmc-1az90,1h-isoindole-1, n-ethyl PubChem CID: 21120 IUPAC Name: 2-ethylisoindole-1,3-dione SMILES: CCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 21120 |
|---|---|
| CAS | 5022-29-7 |
| Molecular Weight (g/mol) | 175.187 |
| MDL Number | MFCD00014583 |
| SMILES | CCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-ethylphthalimide,2-ethylisoindoline-1,3-dione,phthalimide, n-ethyl,1h-isoindole-1,3 2h-dione, 2-ethyl,2-ethyl-1h-isoindole-1,3 2h-dione,1h-isoindole-1,3 2h-dione, n-ethyl,2-ethylbenzo c azoline-1,3-dione,acmc-1az90,1h-isoindole-1, n-ethyl |
| IUPAC Name | 2-ethylisoindole-1,3-dione |
| InChI Key | JZDSOQSUCWVBMV-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
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 3,3-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 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 |
Calcium propionate hydrate, 97%
CAS: 4075-81-4 Molecular Formula: C6H10CaO4 Molecular Weight (g/mol): 186.22 MDL Number: MFCD00167354 InChI Key: BCZXFFBUYPCTSJ-UHFFFAOYSA-L Synonym: calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 PubChem CID: 19999 ChEBI: CHEBI:81716 IUPAC Name: calcium;propanoate SMILES: [Ca++].CCC([O-])=O.CCC([O-])=O
| PubChem CID | 19999 |
|---|---|
| CAS | 4075-81-4 |
| Molecular Weight (g/mol) | 186.22 |
| ChEBI | CHEBI:81716 |
| MDL Number | MFCD00167354 |
| SMILES | [Ca++].CCC([O-])=O.CCC([O-])=O |
| Synonym | calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 |
| IUPAC Name | calcium;propanoate |
| InChI Key | BCZXFFBUYPCTSJ-UHFFFAOYSA-L |
| Molecular Formula | C6H10CaO4 |
N-(4-Bromobutyl)phthalimide, 96%
CAS: 5394-18-3 Molecular Formula: C12H12BrNO2 Molecular Weight (g/mol): 282.14 MDL Number: MFCD00005905 InChI Key: UXFWTIGUWHJKDD-UHFFFAOYSA-N Synonym: n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide PubChem CID: 93575 IUPAC Name: 2-(4-bromobutyl)isoindole-1,3-dione SMILES: BrCCCCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 93575 |
|---|---|
| CAS | 5394-18-3 |
| Molecular Weight (g/mol) | 282.14 |
| MDL Number | MFCD00005905 |
| SMILES | BrCCCCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide |
| IUPAC Name | 2-(4-bromobutyl)isoindole-1,3-dione |
| InChI Key | UXFWTIGUWHJKDD-UHFFFAOYSA-N |
| Molecular Formula | C12H12BrNO2 |
1,3-Dichloro-5,5-dimethylhydantoin, 98%
CAS: 118-52-5 Molecular Formula: C5H6Cl2N2O2 Molecular Weight (g/mol): 197.015 MDL Number: MFCD00003190 InChI Key: KEQGZUUPPQEDPF-UHFFFAOYSA-N Synonym: 1,3-dichloro-5,5-dimethylhydantoin,dantoin,dactin,daktin,dichlorantin,omchlor,halane,hydan,hydantoin, dichlorodimethyl,hydan antiseptic PubChem CID: 8360 IUPAC Name: 1,3-dichloro-5,5-dimethylimidazolidine-2,4-dione SMILES: CC1(C(=O)N(C(=O)N1Cl)Cl)C
| PubChem CID | 8360 |
|---|---|
| CAS | 118-52-5 |
| Molecular Weight (g/mol) | 197.015 |
| MDL Number | MFCD00003190 |
| SMILES | CC1(C(=O)N(C(=O)N1Cl)Cl)C |
| Synonym | 1,3-dichloro-5,5-dimethylhydantoin,dantoin,dactin,daktin,dichlorantin,omchlor,halane,hydan,hydantoin, dichlorodimethyl,hydan antiseptic |
| IUPAC Name | 1,3-dichloro-5,5-dimethylimidazolidine-2,4-dione |
| InChI Key | KEQGZUUPPQEDPF-UHFFFAOYSA-N |
| Molecular Formula | C5H6Cl2N2O2 |
Methyl 1-methylpyrrole-2-carboxylate, 99%
CAS: 37619-24-2 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00052747 InChI Key: APHVGKYWHWFAQV-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-pyrrole-2-carboxylate,methyl1-methyl-1h-pyrrole-2-carboxylate,1-methyl-1h-pyrrole-2-carboxylic acid methyl ester,methyl 1-methyl-2-pyrrolecarboxylate,1-methylpyrrole-2-carboxylic acid methyl ester,pubchem12438,acmc-209iue,methylmethylpyrrolecarboxylate,2-methoxycarbonyl-1-methylpyrrole,methyl 1-methyl-pyrrole-2-carboxylate PubChem CID: 142178 IUPAC Name: methyl 1-methylpyrrole-2-carboxylate SMILES: CN1C=CC=C1C(=O)OC
| PubChem CID | 142178 |
|---|---|
| CAS | 37619-24-2 |
| Molecular Weight (g/mol) | 139.154 |
| MDL Number | MFCD00052747 |
| SMILES | CN1C=CC=C1C(=O)OC |
| Synonym | methyl 1-methyl-1h-pyrrole-2-carboxylate,methyl1-methyl-1h-pyrrole-2-carboxylate,1-methyl-1h-pyrrole-2-carboxylic acid methyl ester,methyl 1-methyl-2-pyrrolecarboxylate,1-methylpyrrole-2-carboxylic acid methyl ester,pubchem12438,acmc-209iue,methylmethylpyrrolecarboxylate,2-methoxycarbonyl-1-methylpyrrole,methyl 1-methyl-pyrrole-2-carboxylate |
| IUPAC Name | methyl 1-methylpyrrole-2-carboxylate |
| InChI Key | APHVGKYWHWFAQV-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO2 |
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 |
L-Ascorbic acid, ≥99%, MP Biomedicals™
CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonym: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate PubChem CID: 131674100 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
| PubChem CID | 131674100 |
|---|---|
| CAS | 134-03-2 |
| Molecular Weight (g/mol) | 198.11 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| Synonym | sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
Methyl 3-bromopropionate, 97%
CAS: 3395-91-3 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00000250 InChI Key: KQEVIFKPZOGBMZ-UHFFFAOYSA-N Synonym: methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester PubChem CID: 76934 IUPAC Name: methyl 3-bromopropanoate SMILES: COC(=O)CCBr
| PubChem CID | 76934 |
|---|---|
| CAS | 3395-91-3 |
| Molecular Weight (g/mol) | 167.00 |
| MDL Number | MFCD00000250 |
| SMILES | COC(=O)CCBr |
| Synonym | methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester |
| IUPAC Name | methyl 3-bromopropanoate |
| InChI Key | KQEVIFKPZOGBMZ-UHFFFAOYSA-N |
| Molecular Formula | C4H7BrO2 |
Butyl methacrylate, 99%, stabilized
CAS: 97-88-1 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00009444 InChI Key: SOGAXMICEFXMKE-UHFFFAOYSA-N Synonym: butyl methacrylate,n-butyl methacrylate,butylmethacrylate,2-propenoic acid, 2-methyl-, butyl ester,butyl 2-methacrylate,butylmethacrylaat,2-methyl-butylacrylat,butil metacrilato,2-methyl-butylacrylaat,2-methyl-butylacrylate PubChem CID: 7354 IUPAC Name: butyl 2-methylprop-2-enoate SMILES: CCCCOC(=O)C(C)=C
| PubChem CID | 7354 |
|---|---|
| CAS | 97-88-1 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00009444 |
| SMILES | CCCCOC(=O)C(C)=C |
| Synonym | butyl methacrylate,n-butyl methacrylate,butylmethacrylate,2-propenoic acid, 2-methyl-, butyl ester,butyl 2-methacrylate,butylmethacrylaat,2-methyl-butylacrylat,butil metacrilato,2-methyl-butylacrylaat,2-methyl-butylacrylate |
| IUPAC Name | butyl 2-methylprop-2-enoate |
| InChI Key | SOGAXMICEFXMKE-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
N-(3-Hydroxypropyl)phthalimide, 98%
CAS: 883-44-3 Molecular Formula: C11H11NO3 Molecular Weight (g/mol): 205.213 MDL Number: MFCD00023097 InChI Key: BSMILTTURCQDGJ-UHFFFAOYSA-N Synonym: n-3-hydroxypropyl phthalimide,2-3-hydroxypropyl isoindoline-1,3-dione,n-3-hydroxypropyl-phthalimide,1h-isoindole-1,3 2h-dione, 2-3-hydroxypropyl,3-phthalimido-1-propanol,2-3-hydroxypropyl isoindole-1,3-dione,2-3-hydroxypropyl-1h-isoindole-1,3 2h-dione,3-phthalimidopropanol,3-phthalimidylpropanol,acmc-209qsg PubChem CID: 70160 IUPAC Name: 2-(3-hydroxypropyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCO
| PubChem CID | 70160 |
|---|---|
| CAS | 883-44-3 |
| Molecular Weight (g/mol) | 205.213 |
| MDL Number | MFCD00023097 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCO |
| Synonym | n-3-hydroxypropyl phthalimide,2-3-hydroxypropyl isoindoline-1,3-dione,n-3-hydroxypropyl-phthalimide,1h-isoindole-1,3 2h-dione, 2-3-hydroxypropyl,3-phthalimido-1-propanol,2-3-hydroxypropyl isoindole-1,3-dione,2-3-hydroxypropyl-1h-isoindole-1,3 2h-dione,3-phthalimidopropanol,3-phthalimidylpropanol,acmc-209qsg |
| IUPAC Name | 2-(3-hydroxypropyl)isoindole-1,3-dione |
| InChI Key | BSMILTTURCQDGJ-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO3 |
Diallyl maleate, 95%
CAS: 999-21-3 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00010763 InChI Key: ZPOLOEWJWXZUSP-WAYWQWQTSA-N Synonym: diallyl fumarate,fumaric acid, diallyl ester,unii-k852lk4c5p,2-butenedioic acid e-, di-2-propenyl ester,2-butenedioic acid 2e-, di-2-propenyl ester,butenedioic acid diallyl ester,1,4-bis prop-2-en-1-yl 2e-but-2-enedioate,2-butenedioic acid 2e-, 1,4-di-2-propen-1-yl ester,diallyl malleate,1,4-bis prop-2-en-1-yl but-2-enedioate PubChem CID: 5354266 IUPAC Name: bis(prop-2-enyl) (Z)-but-2-enedioate SMILES: C=CCOC(=O)C=CC(=O)OCC=C
| PubChem CID | 5354266 |
|---|---|
| CAS | 999-21-3 |
| Molecular Weight (g/mol) | 196.202 |
| MDL Number | MFCD00010763 |
| SMILES | C=CCOC(=O)C=CC(=O)OCC=C |
| Synonym | diallyl fumarate,fumaric acid, diallyl ester,unii-k852lk4c5p,2-butenedioic acid e-, di-2-propenyl ester,2-butenedioic acid 2e-, di-2-propenyl ester,butenedioic acid diallyl ester,1,4-bis prop-2-en-1-yl 2e-but-2-enedioate,2-butenedioic acid 2e-, 1,4-di-2-propen-1-yl ester,diallyl malleate,1,4-bis prop-2-en-1-yl but-2-enedioate |
| IUPAC Name | bis(prop-2-enyl) (Z)-but-2-enedioate |
| InChI Key | ZPOLOEWJWXZUSP-WAYWQWQTSA-N |
| Molecular Formula | C10H12O4 |