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

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

CAS: 1260637-74-8

Formula: C10H11ClFNO2

SMILES: Cl.OC(=O)C1NCCC2=CC(F)=CC=C12

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

InChI: InChI=1/C10H10FNO2.ClH/c11-7-1-2-8-6(5-7)3-4-12-9(8)10(13)14;/h1-2,5,9,12H,3-4H2,(H,13,14);1H

Composition: C (51.85%), H (4.79%), Cl (15.30%), F (8.20%), N (6.05%), O (13.81%)

Molar Mass: 231.65

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 231.0462345
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JQUQREDVYBIZGK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.66
Topological Polar Surface Area 49.33
Polarizability 18.64
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 1260637-74-8 $126.50-$1,370.80$126.50$143.75$171.35$227.70$342.70$1,370.80
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