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(1S)-1-(5-fluoropyrimidin-2-yl)ethanamine hydrochloride

(1S)-1-(5-fluoropyrimidin-2-yl)ethanamine hydrochloride

CAS: 935667-21-3

Formula: C6H9ClFN3

SMILES: Cl[H].C[C@H](N)C1=NC=C(F)C=N1

IUPAC: (1S)-1-(5-fluoropyrimidin-2-yl)ethan-1-amine hydrochloride

InChI: InChI=1S/C6H8FN3.ClH/c1-4(8)6-9-2-5(7)3-10-6;/h2-4H,8H2,1H3;1H/t4-;/m0./s1

Composition: C (40.58%), H (5.11%), Cl (19.96%), F (10.70%), N (23.66%)

Molar Mass: 177.61

Atom Count: 20

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 177.0469032
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FAXIYWZAHFHREE-WCCKRBBISA-N
Lipinski's Rule of Five 1
Molar Refractivity 35.42
Topological Polar Surface Area 51.8
Polarizability 13.45
Ring Count 1
Rotatable Bond Count 1

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