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4-Isopropylphenyl isocyanate

4-Isopropylphenyl isocyanate structure

CAS No:
31027-31-3
Formula:
C10H11NO
Chemical Name:
4-Isopropylphenyl isocyanate
Synonyms:
Benzene,1-isocyanato-4-(1-methylethyl)-;Isocyanic acid,p-isopropylphenyl ester;1-Isocyanato-4-(1-methylethyl)benzene;p-Isopropylphenyl isocyanate;4-Isopropylphenyl isocyanate;p-Cumenyl isocyanate;4-(1-Methylethyl)phenylisocyanate;1-Isocyanato-4-isopropylbenzene;1-Isocyanato-4-propan-2-ylbenzene;1-Isocyanato-4-(propan-2-yl)benzene
Categories:
Chemical Reagents > Organic Reagents

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Description

clear colorless to yellow or orange liquid

4-Isopropylphenyl isocyanate Basic Attributes

Molecular Weight：

161.2

Exact Mass：

161.20

BRN：

2936403

EC Number：

250-439-9

DSSTox ID：

DTXSID40184999

HScode：

2929109000

Characteristics

PSA：

29.4

XLogP3：

3.92

Appearance：

clear colorless to yellow or orange liquid

Density：

1.0±0.1 g/cm3

Boiling Point：

85 °C4 mm Hg(lit.)

Flash Point：

195 °F

Refractive Index：

1.513

Water Solubility：

Decomposes in water

Storage Conditions：

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

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2206 6.1/PG 3

wgk germany：

hazard class code：

20/21/22-36/37/38-42-34-26

safety instructions：

26-36-45-36/37/39-23

Marks：

Xn,Xi,T+

Stability/Shelf Life：

Stable under normal shipping and handling conditions. May decompose on exposure to moist air or water.

Precautionary statement(s)：

P260, P261, P264, P270, P271, P280, P284, P285, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P304+P341, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (56.52%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P284, P285, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P304+P341, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 69 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Isopropylphenyl isocyanate Use and Manufacturing

Methods of Manufacturing

The preparation method is to react 4-isopropylaniline with phosgene, react for several hours at a certain temperature, and then distill the product.

Uses

4-isopropylphenyl isocyanate is an intermediate of the herbicide isopropyl.

Computed Properties

Molecular Weight:161.20
XLogP3:3.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:161.084063974
Monoisotopic Mass:161.084063974
Topological Polar Surface Area:29.4
Heavy Atom Count:12
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 4-Isopropylphenyl isocyanate

Hangzhou KieRay Chem Co.,LTD Contact Supplier

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4-Isopropylphenyl isocyanate

CAS No.: 31027-31-3

Grade: industrial Grade

Content: 98%

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Guide of 4-Isopropylphenyl isocyanate

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

4-Isopropylphenyl isocyanate

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