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1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid hydrochloride

1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid hydrochloride

CAS: 2097068-75-0

Formula: C10H12ClNO2

SMILES: Cl.OC(=O)C1=CC=C2CNCCC2=C1

IUPAC: 1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid hydrochloride

InChI: InChI=1S/C10H11NO2.ClH/c12-10(13)8-1-2-9-6-11-4-3-7(9)5-8;/h1-2,5,11H,3-4,6H2,(H,12,13);1H

Composition: C (56.22%), H (5.66%), Cl (16.59%), N (6.56%), O (14.98%)

Molar Mass: 213.66

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 213.0556563
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey ACVOHPIGCQRZCW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.87
Topological Polar Surface Area 49.33
Polarizability 18.89
Ring Count 2
Rotatable Bond Count 1

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97% <2 Days 2097068-75-0 $134.55-$1,828.50$134.55$157.55$201.25$286.35$457.70$1,828.50
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