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4-bromo-4'-(3-methylbutoxy)-1,1'-biphenyl

4-bromo-4'-(3-methylbutoxy)-1,1'-biphenyl

Formula: C17H19BrO

SMILES: CC(C)CCOC1=CC=C(C=C1)C1=CC=C(Br)C=C1

IUPAC: 4-bromo-4'-(3-methylbutoxy)-1,1'-biphenyl

InChI: InChI=1S/C17H19BrO/c1-13(2)11-12-19-17-9-5-15(6-10-17)14-3-7-16(18)8-4-14/h3-10,13H,11-12H2,1-2H3

Composition: C (63.96%), H (6.00%), Br (25.03%), O (5.01%)

Molar Mass: 319.242

Atom Count: 38

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 318.061928
Formal Charge 0
FSP3 0.29
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey KDVXZWVTGZVSPI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 83.7
Topological Polar Surface Area 9.23
Polarizability 33.79
Ring Count 2
Rotatable Bond Count 5

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