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2-amino-1-(2-fluorophenyl)ethanone hydrochloride

2-amino-1-(2-fluorophenyl)ethanone hydrochloride

CAS: 93102-96-6

Formula: C8H9ClFNO

SMILES: Cl[H].NCC(=O)C1=CC=CC=C1F

IUPAC: 2-amino-1-(2-fluorophenyl)ethan-1-one hydrochloride

InChI: InChI=1S/C8H8FNO.ClH/c9-7-4-2-1-3-6(7)8(11)5-10;/h1-4H,5,10H2;1H

Composition: C (50.68%), H (4.78%), Cl (18.70%), F (10.02%), N (7.39%), O (8.44%)

Molar Mass: 189.61

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 189.0356698
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GFHFMCRPNVXGFL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.04
Topological Polar Surface Area 43.09
Polarizability 15.26
Ring Count 1
Rotatable Bond Count 2

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