(3,5-dimethylphenyl)(2-methylcyclopropyl)Methanone

HCID 21249913
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
192644-21-6
Standard SMILES
Cc1cc(C)cc(C(=O)C2CC2C)c1
InChIKey
RKMBKJXKQOIWTP-UHFFFAOYSA-N
Molecular formula
C13H16O
Average molar mass
188.26 g/mol
Monoisotopic mass
188.12011513

Names & identifiers

Preferred name
(3,5-dimethylphenyl)(2-methylcyclopropyl)Methanone
IUPAC
(3,5-dimethylphenyl)-(2-methylcyclopropyl)methanone

Names & synonyms

192644-21-6(3,5-dimethylphenyl)(2-methylcyclopropyl)Methanone(3,5-dimethylphenyl)-(2-methylcyclopropyl)methanoneSCHEMBL6978246DTXSID20611617RKMBKJXKQOIWTP-UHFFFAOYSA-NAKOS014758704DA-08724

Database identifiers

CAS
192644-21-6
PubChem CID
21249913
DTXSID
DTXSID20611617
Nikkaji
J1.575.382J

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
14

Related reactions

5 records
New reaction record

Compound notes

Loading…