4-Methyl-1-(1-methyl-2-methylidenecyclopentyl)cyclohex-3-ene-1-(~3~H)carbaldehyde
Basic information
- CAS
105164-39-4- Standard SMILES
[3H]C(=O)[C@]1([C@]2(C)CCCC2=C)CC=C(C)CC1- InChIKey
MKXDGVIQGIXDMG-UISPYCNLSA-N- Molecular formula
- C15H22O
- Average molar mass
- 220.34 g/mol
- Monoisotopic mass
- 220.17528957
Names & identifiers
- Preferred name
- 4-Methyl-1-(1-methyl-2-methylidenecyclopentyl)cyclohex-3-ene-1-(~3~H)carbaldehyde
- IUPAC
- [(1S)-4-methyl-1-[(1R)-1-methyl-2-methylidenecyclopentyl]cyclohex-3-en-1-yl]-tritiomethanone
Names & synonyms
105164-39-4DTXSID609093684-Methyl-1-(1-methyl-2-methylidenecyclopentyl)cyclohex-3-ene-1-(~3~H)carbaldehyde3-Cyclohexene-1-carboxaldehyde-t, 4-methyl-1-(1-methyl-2-methylenecyclopentyl)-, (R*,S*)-(1S)-4-Methyl-1-[(1R)-1-methyl-2-methylidenecyclopentyl]cyclohex-3-ene-1-(~3~H)carbaldehyde
Database identifiers
- CAS
105164-39-4- PubChem CID
- 184451
- DTXSID
DTXSID60909368
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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