Basic information
- CAS
10136-65-9- Standard SMILES
CC1(O)C(=O)CC2CC1C2(C)C- InChIKey
VZRRCQOUNSHSGB-UHFFFAOYSA-N- Molecular formula
- C10H16O2
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.11502975
Names & identifiers
- Preferred name
- Oxypinocamphone
- IUPAC
- 2-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
- English name
- 2-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
- Molecular formula
- C10H16O2
- Molecular weight
- 168.23
Names & synonyms
OxypinocamphoneOxypinone10136-65-9Camphostene2-Hydroxy-3-pinanone3-Hydroxypinocamphone3-Pinanone, 2-hydroxy-EINECS 233-376-1Bicyclo(3.1.1)heptan-3-one, 2-hydroxy-2,6,6-trimethyl-DTXSID90871948Bicyclo[3.1.1]heptan-3-one, 2-hydroxy-2,6,6-trimethyl-RefChem:169080
Show more names
Bicyclo(3.1.1)heptan-3-one, 2-hydroxy-2,6,6-trimethyl- (9ci)
DTXCID40819557Bicyclo(3.1.1)heptan-3-one, 2-hydroxy-2,6,6-trimethyl-(9CI)VZRRCQOUNSHSGB-UHFFFAOYSA-N2-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-3-oneOPC2-Hydroxy-2,6,6-trimethylbicyclo(3.1.1)heptan-3-one2-Hydroxypinan-3-one2-hydroxy-pinanone
Database identifiers
- CAS
10136-65-9- PubChem CID
- 112005
- DTXSID
DTXSID90871948- EC Number
- 233-376-1
- Nikkaji
- J10.649F
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Melting point
- 38.5 °C · 38.5 °C
- Boiling point
- 245 · 245.0±0.0 °C(Predicted)
- Density
- 1.081 · 1.081±0.06 g/cm3(Predicted)
- pka
- 12.93 · 12.93±0.40(Predicted)
- LogP
- 0.995 · 0.995 (est)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers4 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
河北迪远医药技术有限公司13803176464 · [email protected]
Related reactions
6 records
Compound notes
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