3-fluoro-2-methyl-6-nitroaniline

3-fluoro-2-methyl-6-nitroaniline

CAS: 485832-96-0

Formula: C7H7FN2O2

SMILES: CC1=C(N)C(=CC=C1F)[N+]([O-])=O

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

InChI: InChI=1S/C7H7FN2O2/c1-4-5(8)2-3-6(7(4)9)10(11)12/h2-3H,9H2,1H3

Composition: C (49.42%), H (4.15%), F (11.17%), N (16.46%), O (18.81%)

Molar Mass: 170.143

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	170.049155636
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CRPZQUGQOPIFPQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.34
Topological Polar Surface Area	69.16
Polarizability	14.9
Ring Count	1
Rotatable Bond Count	1

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