Cyclopropyl(3,4-dimethylphenyl)methanone
Basic information
- CAS
38675-78-4- Standard SMILES
Cc1ccc(C(=O)C2CC2)cc1C- InChIKey
RVHOLOURUAQTTL-UHFFFAOYSA-N- Molecular formula
- C12H14O
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.10446507
Names & identifiers
- Preferred name
- Cyclopropyl(3,4-dimethylphenyl)methanone
- IUPAC
- cyclopropyl-(3,4-dimethylphenyl)methanone
- English name
- Cyclopropyl-(3,4-dimethylphenyl)methanone
- Molecular formula
- C12H14O
- Molecular weight
- 174.24
Names & synonyms
38675-78-4cyclopropyl(3,4-dimethylphenyl)methanoneCyclopropyl 3,4-Dimethylphenyl Ketonecyclopropyl-(3,4-dimethylphenyl)methanoneCyclopropyl 3,4-xylyl ketoneMFCD00019226MLS002693751NSC71983EINECS 254-077-2CHEMBL1871769DTXSID30191970RVHOLOURUAQTTL-UHFFFAOYSA-N
Show more names
Methanone, cyclopropyl(3,4-dimethylphenyl)-
HMS3088B10NBA67578NSC 71983NSC-71983AKOS009342562SMR001559693SY381054CS-0259509
Database identifiers
- CAS
38675-78-4- PubChem CID
- 96398
- DTXSID
DTXSID30191970- ChEMBL
CHEMBL1871769- EC Number
- 254-077-2
- Nikkaji
- J319.824C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
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
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Related reactions
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Compound notes
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