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5,6,7,8-tetrahydroisoquinolin-5-amine dihydrochloride

5,6,7,8-tetrahydroisoquinolin-5-amine dihydrochloride

CAS: 1263378-92-2

Formula: C9H14Cl2N2

SMILES: Cl.Cl.NC1CCCC2=CN=CC=C12

IUPAC: 5,6,7,8-tetrahydroisoquinolin-5-amine dihydrochloride

InChI: InChI=1/C9H12N2.2ClH/c10-9-3-1-2-7-6-11-5-4-8(7)9;;/h4-6,9H,1-3,10H2;2*1H

Composition: C (48.89%), H (6.38%), Cl (32.06%), N (12.67%)

Molar Mass: 221.13

Atom Count: 27

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 220.0534039
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QMIDWHZGYFOVHB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.56
Topological Polar Surface Area 38.91
Polarizability 17.52
Ring Count 2
Rotatable Bond Count 0

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96% <2 Days 1263378-92-2 $154.10-$2,852.00$154.10$194.35$273.70$431.25$747.50$2,852.00
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