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4-Isocyanato-1-methyl-2-nitrobenzene

4-Isocyanato-1-methyl-2-nitrobenzene structure

CAS No:
13471-69-7
Formula:
C8H6N2O3
Chemical Name:
4-Isocyanato-1-methyl-2-nitrobenzene
Synonyms:
Benzene,4-isocyanato-1-methyl-2-nitro-;Isocyanic acid,3-nitro-p-tolyl ester;4-Isocyanato-1-methyl-2-nitrobenzene;4-Isocyanato-2-nitrotoluene;3-Nitro-4-methylphenyl isocyanate;4-Methyl-3-nitrophenyl isocyanate;2-Nitro-4-isocyanatotoluene;NSC 158456
Categories:
Chemical Reagents > Organic Reagents

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Description

yellow crystals

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

Molecular Weight：

178.14

Exact Mass：

178.14

BRN：

2724128

NSC Number：

158456

DSSTox ID：

DTXSID1065500

HScode：

29291000

Characteristics

PSA：

75.2

XLogP3：

2.39370

Appearance：

yellow crystals

Density：

1.4114 (rough estimate)

Melting Point：

51-54 °C(lit.)

Boiling Point：

100-102 °C @ Press: 0.2 Torr

Flash Point：

>230 °F

Refractive Index：

1.6000 (estimate)

Storage Conditions：

0-6°C

Vapor Pressure：

0.00311mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

7-26-27-37/39

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

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

Manufacturing Info：

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

Computed Properties

Molecular Weight:178.14
XLogP3:3.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:178.03784206
Monoisotopic Mass:178.03784206
Topological Polar Surface Area:75.2
Heavy Atom Count:13
Complexity:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 4-Isocyanato-1-methyl-2-nitrobenzene

Henan Lihao Chem Plant Limited Contact Supplier

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4-Methyl-3-nitrophenyl isocyanate 99% kanbei

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Guide of 4-Isocyanato-1-methyl-2-nitrobenzene

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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4-Isocyanato-1-methyl-2-nitrobenzene

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