1-(3-bromophenyl)methanamine hydrochloride

1-(3-bromophenyl)methanamine hydrochloride

CAS: 39959-54-1

Formula: C7H9BrClN

SMILES: Cl.NCC1=CC=CC(Br)=C1

IUPAC: 1-(3-bromophenyl)methanamine hydrochloride

InChI: InChI=1S/C7H8BrN.ClH/c8-7-3-1-2-6(4-7)5-9;/h1-4H,5,9H2;1H

Composition: C (37.79%), H (4.08%), Br (35.91%), Cl (15.93%), N (6.29%)

Molar Mass: 222.51

Atom Count: 19

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.96069
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	UGEQUCUBWNAUJS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.15
Topological Polar Surface Area	26.02
Polarizability	16.43
Ring Count	1
Rotatable Bond Count	1

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