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2-[(1R)-1-amino-2-hydroxyethyl]-5-fluorophenol hydrochloride

2-[(1R)-1-amino-2-hydroxyethyl]-5-fluorophenol hydrochloride

CAS: 2177257-85-9

Formula: C8H11ClFNO2

SMILES: Cl.N[C@@H](CO)C1=CC=C(F)C=C1O

IUPAC: 2-[(1R)-1-amino-2-hydroxyethyl]-5-fluorophenol hydrochloride

InChI: InChI=1S/C8H10FNO2.ClH/c9-5-1-2-6(7(10)4-11)8(12)3-5;/h1-3,7,11-12H,4,10H2;1H/t7-;/m0./s1

Composition: C (46.28%), H (5.34%), Cl (17.07%), F (9.15%), N (6.75%), O (15.41%)

Molar Mass: 207.63

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 207.0462345
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey DPQZVOINFPLYHQ-FJXQXJEOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.69
Topological Polar Surface Area 66.48
Polarizability 16.47
Ring Count 1
Rotatable Bond Count 2

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