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2-Fluoro-5-nitrotoluene

2-Fluoro-5-nitrotoluene structure

CAS No:
455-88-9
Formula:
C7H6FNO2
Chemical Name:
2-Fluoro-5-nitrotoluene
Synonyms:
Benzene,1-fluoro-2-methyl-4-nitro-;Toluene,2-fluoro-5-nitro-;1-Fluoro-2-methyl-4-nitrobenzene;2-Fluoro-5-nitrotoluene;3-Methyl-4-fluoronitrobenzene;5-Nitro-2-fluorotoluene;4-Fluoro-3-methylnitrobenzene;2-Methyl-4-nitrofluorobenzene;4-Fluoro-3-methyl-1-nitrobenzene
Categories:
Chemical Reagents > Organic Reagents

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Description

white to light yellow crystal powder

2-Fluoro-5-nitrotoluene Basic Attributes

Molecular Weight：

155.13

Exact Mass：

155.13

BRN：

1940341

EC Number：

207-251-7

DSSTox ID：

DTXSID9060021

HScode：

29049090

Characteristics

PSA：

45.8

XLogP3：

2.8

Appearance：

yellow crystals or crystalline chunks

Density：

1.3±0.1 g/cm3

Melting Point：

41 °C

Boiling Point：

99.4-99.6 °C @ Press: 13 Torr

Flash Point：

221 °F

Refractive Index：

1.530

Storage Conditions：

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Vapor Pressure：

0.147mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN2811

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36-36/37/39-22

Marks：

Xn,Xi

Hazard note：

Irritant

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H312-H315-H319-H332-H335

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 48 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Fluoro-5-nitrotoluene Use and Manufacturing

Methods of Manufacturing

To an oven-dried resealable tube equipped with a stir bar was added aryl halide as depicted in FIG. 20 (0.12 mmol), BrettPhos (6.4 mg, 0.012 mmol, 10 mol percent), (COD)Pd(CH

Manufacturing Info：

Benzene, 1-fluoro-2-methyl-4-nitro-: INACTIVE

Computed Properties

Molecular Weight:155.13
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Exact Mass:155.03825660
Monoisotopic Mass:155.03825660
Topological Polar Surface Area:45.8
Heavy Atom Count:11
Complexity:157
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 455-88-9

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