Ethyl tiglate
Properties
- Molecular formula
- C7H12O2
- Molar mass
- 128.17 g/mol
- Exact mass
- 128.0837 Da
- Boiling point
- 156 °C
- logP
- 1.52Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 2
Identifiers
CAS number
5837-78-5SMILES
C/C=C(C)C(=O)OCCInChIKey
OAPHLAAOJMTMLY-GQCTYLIASA-NInChI
InChI=1S/C7H12O2/c1-4-6(3)7(8)9-5-2/h4H,5H2,1-3H3/b6-4+Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- 2-Butenoic acid, 2-methyl-, ethyl ester, (2E)-
- Crotonic acid, 2-methyl-, ethyl ester, (E)-
- Tiglic acid, ethyl ester
- 2-Butenoic acid, 2-methyl-, ethyl ester, (E)-
- Ethyl α-methylcrotonate
- (E)-2-Methyl-2-butenoic acid ethyl ester
- NSC 55278
- (E)-Ethyl 2-methylbut-2-enoate
- Ethyl (2E)-2-methyl-2-butenoate
- Ethyl trans-2-methyl-2-butenoate
- (E)-2-Methylbut-2-enoic acid ethyl ester
Work with Ethyl tiglate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Ethyl 2-methyl-4,4,4-trifluorocrotonate128227-97-463 % similar
(Z)-3-Hexenyl tiglate67883-79-857 % similar
Diethyl oxalate95-92-156 % similar
Methyl tiglate6622-76-055 % similar
Benzyl tiglate37526-88-853 % similar
1,1,2,2-Tetraethyl 1,1,2,2-ethenetetracarboxylate6174-95-452 % similar
Ethyl pyruvate617-35-652 % similar
Diethyl oxomalonate609-09-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds