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1-(3-chloro-5-fluoropyridin-2-yl)methanamine

1-(3-chloro-5-fluoropyridin-2-yl)methanamine

CAS: 1211578-98-1

Formula: C6H6ClFN2

SMILES: NCC1=NC=C(F)C=C1Cl

IUPAC: 1-(3-chloro-5-fluoropyridin-2-yl)methanamine

InChI: InChI=1S/C6H6ClFN2/c7-5-1-4(8)3-10-6(5)2-9/h1,3H,2,9H2

Composition: C (44.88%), H (3.77%), Cl (22.08%), F (11.83%), N (17.45%)

Molar Mass: 160.58

Atom Count: 16

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 160.0203541
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KKJMCACONZERJV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.87
Topological Polar Surface Area 38.91
Polarizability 14.43
Ring Count 1
Rotatable Bond Count 1

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97% <2 Days 1211578-98-1 $373.75-$4,597.70$373.75$631.35$1,147.70$4,597.70
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