1-bromo-4-phenylisoquinolin-3-amine

1-bromo-4-phenylisoquinolin-3-amine

CAS: 338420-83-0

Formula: C15H11BrN2

SMILES: NC1=C(C2=CC=CC=C2)C2=CC=CC=C2C(Br)=N1

IUPAC: 1-bromo-4-phenylisoquinolin-3-amine

InChI: InChI=1S/C15H11BrN2/c16-14-12-9-5-4-8-11(12)13(15(17)18-14)10-6-2-1-3-7-10/h1-9H,(H2,17,18)

Composition: C (60.22%), H (3.71%), Br (26.71%), N (9.36%)

Molar Mass: 299.171

Atom Count: 29

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	298.010561
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LARMTFYJMWKZRI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.97
Topological Polar Surface Area	38.91
Polarizability	31.72
Ring Count	3
Rotatable Bond Count	1

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90%	<2 Days	338420-83-0		$51.35-$86.31$51.35$63.37$86.31