3-Cyclohexene-1-carboxaldehyde, 4,5-dimethyl-2-(2-methyl-1-propen-1-yl)-, (1R,2S,5R)-rel-
Basic information
- CAS
42507-57-3- Standard SMILES
CC(C)=C[C@H]1C=C(C)[C@H](C)C[C@H]1C=O- InChIKey
DBKJZSIBBKOBCN-AGIUHOORSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- 3-Cyclohexene-1-carboxaldehyde, 4,5-dimethyl-2-(2-methyl-1-propen-1-yl)-, (1R,2S,5R)-rel-
- IUPAC
- (1R,2S,5R)-4,5-dimethyl-2-(2-methylprop-1-enyl)cyclohex-3-ene-1-carbaldehyde
Names & synonyms
42507-57-33-Cyclohexene-1-carboxaldehyde, 4,5-dimethyl-2-(2-methyl-1-propenyl)-, (1R,2S,5R)-rel-EINECS 255-860-1DTXSID408848263-Cyclohexene-1-carboxaldehyde, 4,5-dimethyl-2-(2-methyl-1-propen-1-yl)-, (1R,2S,5R)-rel-RefChem:93581DTXCID601024247(1alpha,2alpha,5beta)-4,5-Dimethyl-2-(2-methylpropen-1-yl)cyclohex-3-ene-1-carbaldehydeDBKJZSIBBKOBCN-AGIUHOORSA-N(1R,2S,5R)-4,5-dimethyl-2-(2-methylprop-1-en-1-yl)cyclohex-3-ene-1-carbaldehyde
Database identifiers
- CAS
42507-57-3- PubChem CID
- 170658
- DTXSID
DTXSID40884826- EC Number
- 255-860-1
- Nikkaji
- J305.021A
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 269
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Cyclohexene-1-carboxaldehyde, 4,5-dimethyl-2-(2-methyl-1-propen-1-yl)-, (1R,2S,5R)-rel-: INACTIVE
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…