2,4-Dimethylheptan-2-ol
Basic information
- CAS
65822-93-7- Standard SMILES
CCCC(C)CC(C)(C)O- InChIKey
VORBOMMQBCSRQF-UHFFFAOYSA-N- Molecular formula
- C9H20O
- Average molar mass
- 144.25 g/mol
- Monoisotopic mass
- 144.15141526
Names & identifiers
- Preferred name
- 2,4-Dimethylheptan-2-ol
- IUPAC
- 2,4-dimethylheptan-2-ol
Names & synonyms
2,4-dimethylheptan-2-ol65822-93-72-Heptanol, 2,4-dimethyl-2,4-DIMETHYL-2-HEPTANOLSCHEMBL2764325SCHEMBL2764329DTXSID40334876AKOS014478656CS-0278155EN300-1866930
Database identifiers
- CAS
65822-93-7- PubChem CID
- 522187
- DTXSID
DTXSID40334876- Nikkaji
- J213.784D
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 86.7
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Related reactions
2 records
Compound notes
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