Basic information
- CAS
50390-68-6- Standard SMILES
CC1(c2ccccc2)CCCC1=O- InChIKey
TYRYXIDSYINSHM-UHFFFAOYSA-N- Molecular formula
- C12H14O
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.10446507
Names & identifiers
- Preferred name
- 2-Methyl-2-phenyl-cyclopentanone
- IUPAC
- 2-methyl-2-phenylcyclopentan-1-one
- English name
- 2-Methyl-2-phenyl-cyclopentanone
- Molecular formula
- C12H14O
- Molecular weight
- 174.24
Names & synonyms
2-METHYL-2-PHENYL-CYCLOPENTANONE50390-68-6DTXSID70325378RefChem:263156DTXCID502764952-methyl-2-phenylcyclopentan-1-one2-methyl-2-phenylcyclopentanoneNSC409887SCHEMBL512374TYRYXIDSYINSHM-UHFFFAOYSA-NAKOS006289829NSC-409887
Show more names
2-Phenyl-2-methylcyclopentanoneCyclopentanone, 2-methyl-2-phenyl-
Database identifiers
- CAS
50390-68-6- PubChem CID
- 349941
- DTXSID
DTXSID70325378- Nikkaji
- J427.179C
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 203
Chemistry & industry
Suppliers4 total
APAC Pharmaceutical, LLC[email protected]
Leancare Ltd.[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]
Related reactions
9 records
Compound notes
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