Basic information
- CAS
24143-52-0- Standard SMILES
CC(C)(C)C1CCC2CC(=O)CCC2C1- InChIKey
QQKVQRVPUCGGKW-UHFFFAOYSA-N- Molecular formula
- C14H24O
- Average molar mass
- 208.34 g/mol
- Monoisotopic mass
- 208.18271539
Overview
See other relationships...
Names & identifiers
- Preferred name
- cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one
- IUPAC
- 6-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-one
Names & synonyms
24143-52-06alpha-tert-Butyl-3,4,4abeta,5,6,7,8,8abeta-octahydronaphthalen-2(1H)-one24817-24-1EINECS 246-033-6cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one6-tert-butyloctahydronaphthalen-2(1h)-oneEINECS 246-473-9DTXSID90946968QQKVQRVPUCGGKW-UHFFFAOYSA-NEINECS 246-474-4NS00084110NS00084742
Show more names
6alpha-tert-Butyl-3,4,4abeta,5,6,7,8,8aalpha-octahydronaphthalen-2(1H)-one
Database identifiers
- CAS
24143-52-0、24817-24-1、24817-28-5- PubChem CID
- 91128
- DTXSID
DTXSID90946968- EC Number
- 246-033-6、246-473-9
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
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Compound notes
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