Basic information
- Standard SMILES
CC(OC(C)(C)CO)C1CCCC(C)(C)C1- InChIKey
CJBXHTMAMPXERG-UHFFFAOYSA-N- Molecular formula
- C14H28O2
- Average molar mass
- 228.37 g/mol
- Monoisotopic mass
- 228.20893014
Names & identifiers
- Preferred name
- 2-[1-(3,3-Dimethyl-cyclohexyl)-ethoxy]-2-methyl-propan-1-ol
- IUPAC
- 2-[1-(3,3-dimethylcyclohexyl)ethoxy]-2-methylpropan-1-ol
Names & synonyms
SCHEMBL1396689CJBXHTMAMPXERG-UHFFFAOYSA-NDTXSID1011997502-[1-(3,3-Dimethylcyclohexyl)ethoxy]-2-methyl-1-propanol2-[1-(3,3-dimethylcyclohexyl)ethoxy]-2-methylpropan-1-ol2-[1-(3,3-dimethyl-cyclohexyl)-ethoxy]-2-methyl-propan-1-ol2-[1'-(3'',3''-dimethylcyclohexyl)-ethoxy]-2-methylpropan-1-ol2-[1'-(3'',3''-dimethylcyclohexyl)ethoxy]-2-methylpropan-1-ol141773-71-9
Database identifiers
- CAS
141773-71-9- PubChem CID
- 12022012
- DTXSID
DTXSID101199750
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 221
Related reactions
2 records
Linked notes
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