Basic information
- CAS
61142-36-7- Standard SMILES
C=C(C)C(=CCC)CC- InChIKey
ICVZMTIGTXBIHI-UHFFFAOYSA-N- Molecular formula
- C9H16
- Average molar mass
- 124.22 g/mol
- Monoisotopic mass
- 124.12520051
Names & identifiers
- Preferred name
- 3-Ethyl-2-methyl-1,3-hexadien
- IUPAC
- 3-ethyl-2-methylhexa-1,3-diene
Names & synonyms
3-ETHYL-2-METHYL-1,3-HEXADIENSCHEMBL8051397DTXSID60866841DB-315396NS00122171
Database identifiers
- CAS
61142-36-7- PubChem CID
- 43553
- DTXSID
DTXSID60866841
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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