1-Fluoro-3-nitrobenzene

CAT: 0931-T21175-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0931-T21175-01Size:100 mg

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CAS Number

402-67-5

Target

Others

Related Pathways

Others

Bioactivity

1-Fluoro-3-nitrobenzene is a bioactive chemical.

Smiles

[O-][N+](=O)c1cccc(F)c1

Molecular Formula

C6H4FNO2

Molecular Weight

141.1

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

1-Fluoro-3-nitrobenzene

CAS Number	402-67-5
PubChem CID	9823
IUPAC Name	1-fluoro-3-nitrobenzene
Molecular Formula	C6H4FNO2
Molecular Weight	141.10
XLogP	1.9
Topological Polar Surface Area	45.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	134

SMILES

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

InChI

InChI=1S/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H

InChIKey

WMASLRCNNKMRFP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 402-67-5

CID: 9823

Formula: C6H4FNO2

MW: 141.10

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	141.10
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	141.02260653
Monoisotopic Mass	141.02260653
Topological Polar Surface Area	45.8 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	134
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
GTR19224610-01	1-Fluoro-3-nitrobenzene
FB105589-01	1-bromo-3-fluoro-2-nitrobenzene
AAA44568-01	2-fluoro-1-methoxy-3-nitrobenzene
LKB76271-01	1-Fluoro-3-iodo-2-nitrobenzene
409247-01	1-Bromo-3-fluoro-5-nitrobenzene
408359-01	1- (Chloromethyl) -3-fluoro-5-nitrobenzene
sc-287137	1-Fluoro-2-methoxy-3-nitrobenzene
sc-224675	1-Fluoro-3-iodo-5-nitrobenzene
sc-346929A	3-fluoro-5-nitrobenzene-1-sulfonamide
PC909882-01	1-Ethoxy-3-fluoro-2-nitrobenzene

1-Fluoro-3-nitrobenzene

Chemical Information

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