1-(bromomethyl)-3-methoxybenzene

1-(bromomethyl)-3-methoxybenzene

CAS: 874-98-6

Formula: C8H9BrO

SMILES: COC1=CC(CBr)=CC=C1

IUPAC: 1-(bromomethyl)-3-methoxybenzene

InChI: InChI=1S/C8H9BrO/c1-10-8-4-2-3-7(5-8)6-9/h2-5H,6H2,1H3

Composition: C (47.79%), H (4.51%), Br (39.74%), O (7.96%)

Molar Mass: 201.063

Atom Count: 19

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	199.983678
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ZKSOJQDNSNJIQW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.37
Topological Polar Surface Area	9.23
Polarizability	17.37
Ring Count	1
Rotatable Bond Count	2

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