1-(4-methylphenyl)propan-2-one

1-(4-methylphenyl)propan-2-one

CAS: 2096-86-8

Formula: C10H12O

SMILES: CC(=O)CC1=CC=C(C)C=C1

IUPAC: 1-(4-methylphenyl)propan-2-one

InChI: InChI=1S/C10H12O/c1-8-3-5-10(6-4-8)7-9(2)11/h3-6H,7H2,1-2H3

Composition: C (81.04%), H (8.16%), O (10.80%)

Molar Mass: 148.205

Atom Count: 23

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	148.088815006
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	NOXKUHSBIXPZBJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.96
Topological Polar Surface Area	17.07
Polarizability	17.7
Ring Count	1
Rotatable Bond Count	2

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