2-(benzyloxy)-6-bromonaphthalene

2-(benzyloxy)-6-bromonaphthalene

CAS: 2234-45-9

Formula: C17H13BrO

SMILES: BrC1=CC2=CC=C(OCC3=CC=CC=C3)C=C2C=C1

IUPAC: 2-(benzyloxy)-6-bromonaphthalene

InChI: InChI=1S/C17H13BrO/c18-16-8-6-15-11-17(9-7-14(15)10-16)19-12-13-4-2-1-3-5-13/h1-11H,12H2

Composition: C (65.20%), H (4.18%), Br (25.51%), O (5.11%)

Molar Mass: 313.194

Atom Count: 32

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	312.014978
Formal Charge	0
FSP3	0.06
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	QVVBDTXZESAKDU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	81.21
Topological Polar Surface Area	9.23
Polarizability	32.58
Ring Count	3
Rotatable Bond Count	3

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