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4-Chloro-1-methyl-2-nitrobenzene

4-Chloro-1-methyl-2-nitrobenzene structure

CAS No:
89-59-8
Formula:
C7H6ClNO2
Chemical Name:
4-Chloro-1-methyl-2-nitrobenzene
Synonyms:
Benzene,4-chloro-1-methyl-2-nitro-;Toluene,4-chloro-2-nitro-;4-Chloro-1-methyl-2-nitrobenzene;4-Chloro-2-nitrotoluene;p-Chloro-o-nitrotoluene;2-Nitro-4-chlorotoluene;4-Chloro-2-nitro-1-methylbenzene;2-Methyl-5-chloronitrobenzene;NSC 5386;1-Chloro-4-methyl-3-nitrobenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear brown liquid after melting

4-Chloro-1-methyl-2-nitrobenzene Basic Attributes

Molecular Weight：

171.58

Exact Mass：

171.58

EC Number：

201-921-2

NSC Number：

5386

DSSTox ID：

DTXSID4058994

HScode：

2904909090

Characteristics

PSA：

45.8

XLogP3：

3.10

Appearance：

acicular crystal

Density：

1.3±0.1 g/cm3

Melting Point：

38 °C

Boiling Point：

242 °C

Flash Point：

98.1±21.8 °C

Refractive Index：

1.570

Water Solubility：

H2O: 109 mg/L (20 ºC)

Storage Conditions：

Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage.

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 3457 6.1/PG 3

wgk germany：

hazard class code：

R20/21/22;R36/37/38

safety instructions：

S26-S36-S36/37/39-S61

Marks：

Xn:Harmful

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H302 (14.58%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P314, P321, P322, P330, P332+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 48 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Bioconcentration：

83.18

4-Chloro-1-methyl-2-nitrobenzene Use and Manufacturing

Manufacturing Info：

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

Computed Properties

Molecular Weight:171.58
XLogP3:3.1
Hydrogen Bond Acceptor Count:2
Exact Mass:171.0087061
Monoisotopic Mass:171.0087061
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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Guide of 4-Chloro-1-methyl-2-nitrobenzene

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Use and Manufacturing
Computed Properties
Latest News
Learn More Other Chemicals

4-Chloro-1-methyl-2-nitrobenzene

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