1,7-Octadiene, 3-methylene-
Basic information
- CAS
68695-13-6- Standard SMILES
C=CCCCC(=C)C=C- InChIKey
VPSGNUSPERBOFO-UHFFFAOYSA-N- Molecular formula
- C9H14
- Average molar mass
- 122.21 g/mol
- Monoisotopic mass
- 122.10955045
Names & identifiers
- Preferred name
- 1,7-Octadiene, 3-methylene-
- IUPAC
- 3-methylideneocta-1,7-diene
Names & synonyms
1,7-Octadiene, 3-methylene-68695-13-6DTXSID10338482RefChem:221725DTXCID70289567VPSGNUSPERBOFO-UHFFFAOYSA-N3-methylideneocta-1,7-diene3-Methylene-1,7-octadiene #SCHEMBL7635356
Database identifiers
- CAS
68695-13-6- PubChem CID
- 549324
- DTXSID
DTXSID10338482
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 109
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Related reactions
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Compound notes
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