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1-Fluoro-3-nitrobenzene

1-Fluoro-3-nitrobenzene structure

CAS No:
402-67-5
Formula:
C6H4FNO2
Chemical Name:
1-Fluoro-3-nitrobenzene
Synonyms:
Benzene,1-fluoro-3-nitro-;1-Fluoro-3-nitrobenzene;m-Fluoronitrobenzene;3-Fluoronitrobenzene;m-Nitrofluorobenzene;3-Nitrofluorobenzene;3-Fluoro-1-nitrobenzene;m-Nitrobenzofluoride;NSC 60651;1-Nitro-3-fluorobenzene
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

clear brown liquid

1-Fluoro-3-nitrobenzene Basic Attributes

Molecular Weight：

141.1

Exact Mass：

141.10

BRN：

1862210

EC Number：

206-953-0

NSC Number：

60651

DSSTox ID：

DTXSID20193201

HScode：

29049085

Characteristics

PSA：

45.8

XLogP3：

1.9

Appearance：

green-yellow

Density：

1.3272 g/cm³ @ Temp: 17.2 °C

Melting Point：

41 °C

Boiling Point：

199 °C

Flash Point：

170 °F

Refractive Index：

1.534

Water Solubility：

H2O: immiscible

Storage Conditions：

Store below +30°C.

Safety Information

Packing level：

Ⅲ

Hazard category：

6.1

Transport codes：

UN 2810 6.1/PG 2

wgk germany：

hazard class code：

23/24/25-33-20/21/22

safety instructions：

36/37-45-36

RTECS Number：

DA1385000

Marks：

T,Xi,Xn

Hazard note：

Toxic/Irritant

Precautionary statement(s)：

P261-P280-P301 + P310-P311

Hazard Statements：

H301 + H311 + H331-H373

1-Fluoro-3-nitrobenzene Use and Manufacturing

Methods of Manufacturing

It is prepared by the reaction between m-dinitrobenzene and potassium fluoride.

Uses

3-Fluoronitrobenzene is a di-substitiuted benzene derivative used for the synthesis of fluoroaromatic compounds through fluorodenitration and other pharmaceuticals.

Computed Properties

Molecular Weight:141.10
XLogP3:1.9
Hydrogen Bond Acceptor Count:3
Exact Mass:141.02260653
Monoisotopic Mass:141.02260653
Topological Polar Surface Area:45.8
Heavy Atom Count:10
Complexity:134
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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