3-(4,5-dihydro-1H-imidazol-2-yl)isoquinoline hydrochloride

3-(4,5-dihydro-1H-imidazol-2-yl)isoquinoline hydrochloride

Formula: C12H12ClN3

SMILES: Cl.C1CN=C(N1)C1=CC2=CC=CC=C2C=N1

IUPAC: 3-(4,5-dihydro-1H-imidazol-2-yl)isoquinoline hydrochloride

InChI: InChI=1S/C12H11N3.ClH/c1-2-4-10-8-15-11(7-9(10)3-1)12-13-5-6-14-12;/h1-4,7-8H,5-6H2,(H,13,14);1H

Composition: C (61.67%), H (5.18%), Cl (15.17%), N (17.98%)

Molar Mass: 233.7

Atom Count: 28

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	233.0719751
Formal Charge	0
FSP3	0.17
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NIGHNKWLMSRCOZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.94
Topological Polar Surface Area	37.28
Polarizability	23.63
Ring Count	3
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C12H12ClN3		Quote Only