(E)-3-Ethoxy-1,1,5-trimethylcyclohexane
Basic information
- CAS
24691-15-4- Standard SMILES
CCO[C@H]1C[C@@H](C)CC(C)(C)C1- InChIKey
JVBNHJDWWBSWLE-ZJUUUORDSA-N- Molecular formula
- C11H22O
- Average molar mass
- 170.29 g/mol
- Monoisotopic mass
- 170.16706532
Overview
See also: Cyclohexane, 3-ethoxy-1,1,5-trimethyl-, cis- (annotation moved to).
Names & identifiers
- Preferred name
- (E)-3-Ethoxy-1,1,5-trimethylcyclohexane
- IUPAC
- cis-(3S,5S)-3-ethoxy-1,1,5-trimethylcyclohexane
Names & synonyms
24691-15-4(3S,5S)-3-ethoxy-1,1,5-trimethylcyclohexaneSCHEMBL8994840DTXSID9051909(E)-3-Ethoxy-1,1,5-trimethylcyclohexane
Database identifiers
- CAS
24691-15-4- PubChem CID
- 14984841
- DTXSID
DTXSID9051909- EC Number
- 246-415-2
- Nikkaji
- J281.511G
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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