Basic information
- CAS
21922-58-7- Standard SMILES
CC12CCCC(C)(CC1)C2=O- InChIKey
MFKQEGZHSFZHAH-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Names & identifiers
- Preferred name
- 1,5-Dimethylbicyclo(3.2.1)octan-8-one
- IUPAC
- 1,5-dimethylbicyclo[3.2.1]octan-8-one
- English name
- 1,5-dimethylbicyclo[3.2.1]octan-8-one
- Molecular formula
- C10H16O
- Molecular weight
- 152.23344
Names & synonyms
1,5-dimethylbicyclo[3.2.1]octan-8-one21922-58-7EINECS 244-662-0DTXSID509445211,5-Dimethylbicyclo(3.2.1)octan-8-oneEC 244-662-0RefChem:73495DTXCID901372861244-662-0RMM649LY45SCHEMBL13582141,5-dimethyl-bicyclo[3.2.1]octane-8-one
Show more names
1,5-dimethylbicyclo [3,2,1] octan-8-one1.5-dimethyl-bicyclo[3.2.1]octane-8-oneNS00004784Bicyclo[3.2.1]octan-8-one, 1,5-dimethyl-
Database identifiers
- CAS
21922-58-7- PubChem CID
- 89555
- DTXSID
DTXSID50944521- UNII
- RMM649LY45
- EC Number
- 244-662-0
- Nikkaji
- J225.484K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 189
Physicochemical properties
- LogP
- 1.981 · 1.981 (est)
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS ClassificationNot Classified
Hazard information
Regulatory Information
Chemical: Bicyclo[3.2.1]octan-8-one, 1,5-dimethyl-
REACH registered substance: 1,5-dimethylbicyclo[3.2.1]octan-8-one (EC: 244-662-0)
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazard Classes and CategoriesNot Classified
Safety data
- REACH Registrations
- Active
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
5 records
Compound notes
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