Basic information
- CAS
14543-49-8- Standard SMILES
C=CCCCC=CCOC- InChIKey
MIJJHRIQVWIQGL-UHFFFAOYSA-N- Molecular formula
- C9H16O
- Average molar mass
- 140.22 g/mol
- Monoisotopic mass
- 140.12011513
Names & identifiers
- Preferred name
- 1-Methoxy-2,7-octadiene
- IUPAC
- 8-methoxyocta-1,6-diene
Names & synonyms
1-methoxy-2,7-octadieneDTXSID401035969RefChem:433478DTXCID802877118-methoxyocta-1,6-dienemethoxy-2,7-octadiene8-methoxy-1,6-octadieneSCHEMBL533948MIJJHRIQVWIQGL-UHFFFAOYSA-NNS00002829
Database identifiers
- CAS
14543-49-8- PubChem CID
- 535026
- DTXSID
DTXSID401035969
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 94.9
Related reactions
4 records
Compound notes
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