(E)-Ethyl 2-methylhex-4-enoate
Completing data — refresh the page later to see the latest
Basic information
- CAS
118942-48-6- Standard SMILES
C/C=C/CC(C)C(=O)OCC- InChIKey
JQFWSELAMIOZPM-GQCTYLIASA-N- Molecular formula
- C9H16O2
- Average molar mass
- 156.22 g/mol
- Monoisotopic mass
- 156.11502975
Names & identifiers
- Preferred name
- (E)-Ethyl 2-methylhex-4-enoate
- IUPAC
- ethyl (E)-2-methylhex-4-enoate
- English name
- (E)-ethyl 2-methylhex-4-enoate(WXC08396)
- Molecular formula
- C9H16O2
- Molecular weight
- 156.22
Names & synonyms
(E)-Ethyl 2-methylhex-4-enoate118942-48-6ethyl (E)-2-methylhex-4-enoateethyl (4E)-2-methylhex-4-enoateSCHEMBL3866359(E)-Ethyl2-methylhex-4-enoateMFCD31652543AKOS037646406AS-68599W16076Ethyl (4E)-2-methyl-4-hexenoate(E)-ethyl 2-methylhex-4-enoate(WXC08396)
Show more names
4-Hexenoic acid, 2-methyl-, ethyl ester, (4E)-
Database identifiers
- CAS
118942-48-6- PubChem CID
- 14288270
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 138
Physicochemical properties
- Boiling point
- 168.4 · 168.4±9.0 °C(Predicted)
- Density
- 0.894 · 0.894±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…