Basic information
- CAS
20231-45-2- Standard SMILES
CC12CCC(CC1=O)C2(C)C=O- InChIKey
BZFVGPPELIFTQP-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- 1,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde
- IUPAC
- 1,7-dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde
- English name
- OXOCAMPHOR
- Molecular weight
- 166.22
Names & synonyms
1,7-dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde20231-45-28-OxocampherSCHEMBL28013184DTXSID20942337BZFVGPPELIFTQP-UHFFFAOYSA-NOXOCAMPHOR8-Oxocamphor
Database identifiers
- CAS
20231-45-2、6004-72-4- PubChem CID
- 5528
- DTXSID
DTXSID20942337- Nikkaji
- J37.997B
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 194 °C · 194 °C
- Boiling point
- 244.377 · 244.377±23.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.175 · 1.175±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Chemistry & industry
Suppliers1 total
Yick-Vic Chemicals & Pharmaceuticals (HK) Ltd(852)2541 2772
Additional notes
DefinitionChEBI: Oxocamphor is a monoterpenoid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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