1-(2,5-dimethylphenyl)propan-1-one

1-(2,5-dimethylphenyl)propan-1-one

CAS: 35031-52-8

Formula: C11H14O

SMILES: CCC(=O)C1=C(C)C=CC(C)=C1

IUPAC: 1-(2,5-dimethylphenyl)propan-1-one

InChI: InChI=1S/C11H14O/c1-4-11(12)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3

Composition: C (81.44%), H (8.70%), O (9.86%)

Molar Mass: 162.232

Atom Count: 26

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	162.104465071
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	MWTJJAYEJFLROK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.17
Topological Polar Surface Area	17.07
Polarizability	19.45
Ring Count	1
Rotatable Bond Count	2

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