(3-bromophenyl)(4-tert-butylphenyl)methanone

(3-bromophenyl)(4-tert-butylphenyl)methanone

CAS: 132885-82-6

Formula: C17H17BrO

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

IUPAC: (3-bromophenyl)(4-tert-butylphenyl)methanone

InChI: InChI=1S/C17H17BrO/c1-17(2,3)14-9-7-12(8-10-14)16(19)13-5-4-6-15(18)11-13/h4-11H,1-3H3

Composition: C (64.37%), H (5.40%), Br (25.19%), O (5.04%)

Molar Mass: 317.226

Atom Count: 36

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	316.046278
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VDVQICJMVFYCKD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	82.92
Topological Polar Surface Area	17.07
Polarizability	31.92
Ring Count	2
Rotatable Bond Count	3

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