8-Methylnona-3,7-dien-2-one
Basic information
- CAS
35408-14-1- Standard SMILES
CC(=O)C=CCCC=C(C)C- InChIKey
LBAQIHZOLWWEAI-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Names & identifiers
- Preferred name
- 8-Methylnona-3,7-dien-2-one
- IUPAC
- 8-methylnona-3,7-dien-2-one
- English name
- 8-Methyl-3,7-nonadien-2-one
- Molecular formula
- C10H16O
- Molecular weight
- 152.23
Names & synonyms
8-methylnona-3,7-dien-2-oneDTXSID0033853235408-14-1RefChem:312213DTXCID602896178-Methyl-3,7-nonadien-2-one3,7-Nonadien-2-one, 8-methyl-, (3E)-
Database identifiers
- CAS
35408-14-1- PubChem CID
- 549667
- DTXSID
DTXSID00338532
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 171
Physicochemical properties
- Boiling point
- 232.4 · 232.4±19.0 °C(Predicted)
- Density
- 0.856 · 0.856±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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