1-(3-bromoquinolin-6-yl)methanamine

1-(3-bromoquinolin-6-yl)methanamine

CAS: 1268261-09-1

Formula: C10H9BrN2

SMILES: NCC1=CC2=CC(Br)=CN=C2C=C1

IUPAC: 1-(3-bromoquinolin-6-yl)methanamine

InChI: InChI=1S/C10H9BrN2/c11-9-4-8-3-7(5-12)1-2-10(8)13-6-9/h1-4,6H,5,12H2

Composition: C (50.66%), H (3.83%), Br (33.70%), N (11.82%)

Molar Mass: 237.1

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	235.994911
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LIQGLKFHQVSJEA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.08
Topological Polar Surface Area	38.91
Polarizability	22.97
Ring Count	2
Rotatable Bond Count	1

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