1-fluoro-3-methoxy-5-nitrobenzene

1-fluoro-3-methoxy-5-nitrobenzene

CAS: 7087-60-7

Formula: C7H6FNO3

SMILES: COC1=CC(=CC(F)=C1)[N+]([O-])=O

IUPAC: 1-fluoro-3-methoxy-5-nitrobenzene

InChI: InChI=1S/C7H6FNO3/c1-12-7-3-5(8)2-6(4-7)9(10)11/h2-4H,1H3

Composition: C (49.13%), H (3.53%), F (11.10%), N (8.19%), O (28.05%)

Molar Mass: 171.127

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	171.03317122
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FPDLQPICBDMTLB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.06
Topological Polar Surface Area	52.37
Polarizability	14.55
Ring Count	1
Rotatable Bond Count	2

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