2-Methyl-5-propan-2-ylnon-6-ene-1,8-diol
Basic information
- Standard SMILES
CC(O)C=CC(CCC(C)CO)C(C)C- InChIKey
KMASBAKBQVORTA-UHFFFAOYSA-N- Molecular formula
- C13H26O2
- Average molar mass
- 214.34 g/mol
- Monoisotopic mass
- 214.19328007
Names & identifiers
- Preferred name
- 2-Methyl-5-propan-2-ylnon-6-ene-1,8-diol
- IUPAC
- 2-methyl-5-propan-2-ylnon-6-ene-1,8-diol
Names & synonyms
NCI60_005931
Database identifiers
- PubChem CID
- 359303
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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