3-(3,4-dimethylbenzoyl)phenyl acetate

3-(3,4-dimethylbenzoyl)phenyl acetate

CAS: 890099-17-9

Formula: C17H16O3

SMILES: CC(=O)OC1=CC=CC(=C1)C(=O)C1=CC=C(C)C(C)=C1

IUPAC: 3-(3,4-dimethylbenzoyl)phenyl acetate

InChI: InChI=1S/C17H16O3/c1-11-7-8-15(9-12(11)2)17(19)14-5-4-6-16(10-14)20-13(3)18/h4-10H,1-3H3

Composition: C (76.10%), H (6.01%), O (17.89%)

Molar Mass: 268.312

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	268.109944375
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	IKMOKAWFIBPLQB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.85
Topological Polar Surface Area	43.37
Polarizability	29.93
Ring Count	2
Rotatable Bond Count	4

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