2-(4-tert-butylbenzoyl)phenyl acetate

2-(4-tert-butylbenzoyl)phenyl acetate

CAS: 890098-40-5

Formula: C19H20O3

SMILES: CC(=O)OC1=CC=CC=C1C(=O)C1=CC=C(C=C1)C(C)(C)C

IUPAC: 2-(4-tert-butylbenzoyl)phenyl acetate

InChI: InChI=1S/C19H20O3/c1-13(20)22-17-8-6-5-7-16(17)18(21)14-9-11-15(12-10-14)19(2,3)4/h5-12H,1-4H3

Composition: C (77.00%), H (6.80%), O (16.20%)

Molar Mass: 296.366

Atom Count: 42

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	296.141244504
Formal Charge	0
FSP3	0.26
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	XHWTUMZIEUKXES-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.43
Topological Polar Surface Area	43.37
Polarizability	33.7
Ring Count	2
Rotatable Bond Count	5

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