Basic information
- Standard SMILES
COC(=O)CCC=C(C)C- InChIKey
NRJSHTINJMCKTR-UHFFFAOYSA-N- Molecular formula
- C8H14O2
- Average molar mass
- 142.2 g/mol
Names & identifiers
- Preferred name
- Methyl 5-methyl-4-hexenoate
- IUPAC
- methyl 5-methylhex-4-enoate
Names & synonyms
Methyl 5-methyl-4-hexenoate35901-76-95-Methyl-4-hexenoic acid methyl estermethyl 5-methyl-4-hexenateSCHEMBL493731Methyl 5-methyl-4- hexenoateMFCD35162192SY579760DB-140002
Database identifiers
- PubChem CID
- 10909672
- Nikkaji
- J93.609J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 132
Related reactions
15 records
Compound notes
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