Basic information
- CAS
160790-49-8- Standard SMILES
CC(C)(O)CC=CCC(C)(C)O- InChIKey
LQBJEGDVJSXOJN-UHFFFAOYSA-N- Molecular formula
- C10H20O2
- Average molar mass
- 172.26 g/mol
- Monoisotopic mass
- 172.14632988
Names & identifiers
- Preferred name
- 4-Octene-2,7-diol, 2,7-dimethyl-, (4Z)-
- IUPAC
- 2,7-dimethyloct-4-ene-2,7-diol
Names & synonyms
4-Octene-2,7-diol, 2,7-dimethyl-, (4Z)-160790-49-82,7-dimethyloct-4-ene-2,7-diolSCHEMBL16506578DTXSID10338260
Database identifiers
- CAS
160790-49-8- PubChem CID
- 547925
- DTXSID
DTXSID10338260
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 139
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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