1-Methylbicyclo[4.1.0]heptan-2-one
Basic information
- CAS
14845-40-0- Standard SMILES
CC12CC1CCCC2=O- InChIKey
ZSCULIADDRFIKK-UHFFFAOYSA-N- Molecular formula
- C8H12O
- Average molar mass
- 124.18 g/mol
- Monoisotopic mass
- 124.088815
Names & identifiers
- Preferred name
- 1-Methylbicyclo[4.1.0]heptan-2-one
- IUPAC
- 1-methylbicyclo[4.1.0]heptan-2-one
- English name
- 1-Methylnorcaran-2-one
- Molecular formula
- C8H12O
- Molecular weight
- 124.18
Names & synonyms
1-Methylbicyclo[4.1.0]heptan-2-one14845-40-01-Methylnorcaran-2-one2-Norcaranone, 1-methyl-Bicyclo[4.1.0]heptan-2-one, 1-methyl-ZSCULIADDRFIKK-UHFFFAOYSA-NPAA84540AKOS0244367491-Methylbicyclo[4.1.0]heptan-2-one #CS-0238866EN300-201395
Database identifiers
- CAS
14845-40-0- PubChem CID
- 548718
- EC Number
- 192-288-0
- Nikkaji
- J100.511A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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