7-bromoisoquinolin-1-amine

7-bromoisoquinolin-1-amine

CAS: 215453-53-5

Formula: C9H7BrN2

SMILES: NC1=C2C=C(Br)C=CC2=CC=N1

IUPAC: 7-bromoisoquinolin-1-amine

InChI: InChI=1S/C9H7BrN2/c10-7-2-1-6-3-4-12-9(11)8(6)5-7/h1-5H,(H2,11,12)

Composition: C (48.46%), H (3.16%), Br (35.82%), N (12.56%)

Molar Mass: 223.073

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	221.979261
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PLOCDXILPIGHEZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.99
Topological Polar Surface Area	38.91
Polarizability	20.76
Ring Count	2
Rotatable Bond Count	0

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