1-(bromomethyl)isoquinoline hydrobromide

1-(bromomethyl)isoquinoline hydrobromide

CAS: 337508-56-2

Formula: C10H9Br2N

SMILES: Br.BrCC1=NC=CC2=CC=CC=C12

IUPAC: 1-(bromomethyl)isoquinoline hydrobromide

InChI: InChI=1S/C10H8BrN.BrH/c11-7-10-9-4-2-1-3-8(9)5-6-12-10;/h1-6H,7H2;1H

Composition: C (39.64%), H (2.99%), Br (52.74%), N (4.62%)

Molar Mass: 302.997

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	300.910175
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	RWSWRJTWPXSENX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.68
Topological Polar Surface Area	12.89
Polarizability	21.34
Ring Count	2
Rotatable Bond Count	1

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