Basic information
- CAS
1331-51-7- Standard SMILES
CCCCCCCC(C)C(C)(C)O- InChIKey
VDYMEZYCCRZRIR-UHFFFAOYSA-N- Molecular formula
- C12H26O
- Average molar mass
- 186.33 g/mol
- Monoisotopic mass
- 186.19836545
Names & identifiers
- Preferred name
- Trimethylnonanol
- IUPAC
- 2,3-dimethyldecan-2-ol
- English name
- Trimethylnonanol
- Molecular weight
- 0
Names & synonyms
trimethylnonanolSCHEMBL61071
Database identifiers
- CAS
1331-51-7- PubChem CID
- 18458409
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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