7-chloroisoquinolin-4-amine

7-chloroisoquinolin-4-amine

CAS: 1369294-23-4

Formula: C9H7ClN2

SMILES: NC1=C2C=CC(Cl)=CC2=CN=C1

IUPAC: 7-chloroisoquinolin-4-amine

InChI: InChI=1S/C9H7ClN2/c10-7-1-2-8-6(3-7)4-12-5-9(8)11/h1-5H,11H2

Composition: C (60.52%), H (3.95%), Cl (19.85%), N (15.68%)

Molar Mass: 178.62

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	178.0297759
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	AWCDJGAMTLNGSX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.86
Topological Polar Surface Area	38.91
Polarizability	19.95
Ring Count	2
Rotatable Bond Count	0

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