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1-Isopropyl-4-nitrobenzene

1-Isopropyl-4-nitrobenzene structure

CAS No:
1817-47-6
Formula:
C9H11NO2
Chemical Name:
1-Isopropyl-4-nitrobenzene
Synonyms:
Benzene,1-(1-methylethyl)-4-nitro-;Cumene,p-nitro-;1-(1-Methylethyl)-4-nitrobenzene;p-Isopropylnitrobenzene;4-Nitrocumene;p-Nitrocumene;1-Isopropyl-4-nitrobenzene;4-Nitroisopropylbenzene;2-(p-Nitrophenyl)propane;4-Isopropylnitrobenzene;4-Isopropyl-1-nitrobenzene;p-Nitroisopropylbenzene;NSC 14494;4-Nitro-1-isopropylbenzene;1-Nitro-4-(propan-2-yl)benzene;1-Nitro-4-propan-2-ylbenzene
Categories:
Agrochemicals > Pesticide Intermediates

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Description

yellow-green liquid

1-Isopropyl-4-nitrobenzene Basic Attributes

Molecular Weight：

165.19

Exact Mass：

165.19

EC Number：

217-326-6

UNII：

4MYK0B424T

NSC Number：

14494

DSSTox ID：

DTXSID6061991

HScode：

2904209090

Characteristics

PSA：

45.8

XLogP3：

3.29

Appearance：

Yellow-green liquid

Density：

1.0852 g/cm³ @ Temp: 20 °C

Melting Point：

35.17°C (estimate)

Boiling Point：

122 °C

Flash Point：

>230 °F

Refractive Index：

n 20/D 1.537(lit.)

Vapor Pressure：

0.0728mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Stability/Shelf Life：

Stable. Incompatible with strong bases, strong oxidizing agents.

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-Isopropyl-4-nitrobenzene Use and Manufacturing

Methods of Manufacturing

The preparation method is prepared by reacting cumene with mixed acid (nitric acid and sulfuric acid). The reaction liquid contains para, ortho and meta nitrocumene. After rectification and separation, 4-nitroisopropylbenzene is obtained. Propylbenzene.

Uses

4-Nitroisopropylbenzene is an intermediate of the herbicide isopropyl.

Manufacturing Info：

Benzene, 1-(1-methylethyl)-4-nitro-: INACTIVE

Computed Properties

Molecular Weight:165.19
XLogP3:3.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:165.078978594
Monoisotopic Mass:165.078978594
Topological Polar Surface Area:45.8
Heavy Atom Count:12
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Isopropyl-4-nitrobenzene

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

1-Isopropyl-4-nitrobenzene

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