Basic information
- CAS
13894-60-5- Standard SMILES
CC=CCCC(=O)OC- InChIKey
MEZYCNMPBPQTLK-UHFFFAOYSA-N- Molecular formula
- C7H12O2
- Average molar mass
- 128.17 g/mol
- Monoisotopic mass
- 128.08372962
Names & identifiers
- Preferred name
- Methyl hex-4-enoate
- IUPAC
- methyl hex-4-enoate
- English name
- (Z)-4-Hexenoic acid methyl ester
- Molecular weight
- 0
Names & synonyms
13894-60-52396-79-4METHYL HEX-4-ENOATE4-Hexenoic acid methyl esterSCHEMBL1759112SCHEMBL6959058SCHEMBL16287984DTXSID60930258(Z)-4-Hexenoic acid methyl ester
Database identifiers
- CAS
13894-60-5、2396-79-4- PubChem CID
- 549264
- DTXSID
DTXSID60930258
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 105
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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