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3,5-difluoro-2-nitroaniline

3,5-difluoro-2-nitroaniline

CAS: 361-72-8

Formula: C6H4F2N2O2

SMILES: NC1=C(C(F)=CC(F)=C1)[N+]([O-])=O

IUPAC: 3,5-difluoro-2-nitroaniline

InChI: InChI=1S/C6H4F2N2O2/c7-3-1-4(8)6(10(11)12)5(9)2-3/h1-2H,9H2

Composition: C (41.39%), H (2.32%), F (21.82%), N (16.09%), O (18.38%)

Molar Mass: 174.107

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 174.024083703
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZULNIHUDSFLCBT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.51
Topological Polar Surface Area 69.16
Polarizability 13.05
Ring Count 1
Rotatable Bond Count 1

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