4-bromo-2,3-dihydro-1H-isoindole hydrochloride

4-bromo-2,3-dihydro-1H-isoindole hydrochloride

CAS: 923590-95-8

Formula: C8H9BrClN

SMILES: Cl.BrC1=CC=CC2=C1CNC2

IUPAC: 4-bromo-2,3-dihydro-1H-isoindole hydrochloride

InChI: InChI=1S/C8H8BrN.ClH/c9-8-3-1-2-6-4-10-5-7(6)8;/h1-3,10H,4-5H2;1H

Composition: C (40.97%), H (3.87%), Br (34.07%), Cl (15.12%), N (5.97%)

Molar Mass: 234.52

Atom Count: 20

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	232.96069
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	FQHLHVFOJBANKY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.48
Topological Polar Surface Area	12.03
Polarizability	17.54
Ring Count	2
Rotatable Bond Count	0

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