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decahydroisoquinoline-3-carboxylic acid hydrochloride

decahydroisoquinoline-3-carboxylic acid hydrochloride

CAS: 99189-26-1

Formula: C10H18ClNO2

SMILES: Cl.OC(=O)C1CC2CCCCC2CN1

IUPAC: decahydroisoquinoline-3-carboxylic acid hydrochloride

InChI: InChI=1/C10H17NO2.ClH/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9;/h7-9,11H,1-6H2,(H,12,13);1H

Composition: C (54.67%), H (8.26%), Cl (16.13%), N (6.38%), O (14.56%)

Molar Mass: 219.71

Atom Count: 32

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 3
Exact Mass 219.1026065
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey UHPVXZBGHNSXBU-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.09
Topological Polar Surface Area 49.33
Polarizability 19.74
Ring Count 2
Rotatable Bond Count 1

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 99189-26-1 $134.55-$1,828.50$134.55$157.55$201.25$286.35$457.70$1,828.50
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