2-chloro-3-fluoro-6-nitroaniline

2-chloro-3-fluoro-6-nitroaniline

CAS: 948014-34-4

Formula: C6H4ClFN2O2

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

IUPAC: 2-chloro-3-fluoro-6-nitroaniline

InChI: InChI=1S/C6H4ClFN2O2/c7-5-3(8)1-2-4(6(5)9)10(11)12/h1-2H,9H2

Composition: C (37.82%), H (2.12%), Cl (18.60%), F (9.97%), N (14.70%), O (16.79%)

Molar Mass: 190.56

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	189.9945332
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BIYFBTINNKCDBR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.1
Topological Polar Surface Area	69.16
Polarizability	15.18
Ring Count	1
Rotatable Bond Count	1

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