2-chloro-1-[(3-fluorophenyl)methoxy]-4-nitrobenzene

2-chloro-1-[(3-fluorophenyl)methoxy]-4-nitrobenzene

CAS: 443882-99-3

Formula: C13H9ClFNO3

SMILES: [O-][N+](=O)C1=CC(Cl)=C(OCC2=CC(F)=CC=C2)C=C1

IUPAC: 2-chloro-1-[(3-fluorophenyl)methoxy]-4-nitrobenzene

InChI: InChI=1S/C13H9ClFNO3/c14-12-7-11(16(17)18)4-5-13(12)19-8-9-2-1-3-10(15)6-9/h1-7H,8H2

Composition: C (55.44%), H (3.22%), Cl (12.59%), F (6.74%), N (4.97%), O (17.04%)

Molar Mass: 281.67

Atom Count: 28

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	281.025499
Formal Charge	0
FSP3	0.08
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	SFTHVDYRPHJAND-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.48
Topological Polar Surface Area	52.37
Polarizability	25.96
Ring Count	2
Rotatable Bond Count	4

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