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N-{2-[(4-azido-2,3,5,6-tetrafluorophenyl)formamido]ethyl}-2-methylprop-2-enamide

N-{2-[(4-azido-2,3,5,6-tetrafluorophenyl)formamido]ethyl}-2-methylprop-2-enamide

Formula: C13H11F4N5O2

SMILES: CC(=C)C(=O)NCCNC(=O)C1=C(F)C(F)=C(N=[N+]=[N-])C(F)=C1F

IUPAC: N-{2-[(4-azido-2,3,5,6-tetrafluorophenyl)formamido]ethyl}-2-methylprop-2-enamide

InChI: InChI=1S/C13H11F4N5O2/c1-5(2)12(23)19-3-4-20-13(24)6-7(14)9(16)11(21-22-18)10(17)8(6)15/h1,3-4H2,2H3,(H,19,23)(H,20,24)

Composition: C (45.23%), H (3.21%), F (22.01%), N (20.28%), O (9.27%)

Molar Mass: 345.258

Atom Count: 35

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 345.084887266
Formal Charge 0
FSP3 0.23
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey GWTPRYVHJTYEPO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.58
Topological Polar Surface Area 87.63
Polarizability 26.74
Ring Count 1
Rotatable Bond Count 6

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C13H11F4N5O2 Quote Only