3-ethylidene-3a-methyl-2,4,5,6,7,7a-hexahydro-1H-indene
Basic information
- CAS
869682-25-7- Standard SMILES
CC=C1CCC2CCCCC12C- InChIKey
PLNRDADPGQMIIQ-UHFFFAOYSA-N- Molecular formula
- C12H20
- Average molar mass
- 164.29 g/mol
- Monoisotopic mass
- 164.15650064
Names & identifiers
- Preferred name
- 3-ethylidene-3a-methyl-2,4,5,6,7,7a-hexahydro-1H-indene
- IUPAC
- 3-ethylidene-3a-methyl-2,4,5,6,7,7a-hexahydro-1H-indene
Names & synonyms
869682-25-73-ethylidene-3a-methyl-2,4,5,6,7,7a-hexahydro-1H-indeneAGN-PC-036ENLSCHEMBL27819233DTXSID503435951-Ethylidene-7a-methyloctahydro-1H-indene
Database identifiers
- CAS
869682-25-7- PubChem CID
- 590780
- DTXSID
DTXSID50343595
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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