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4-ISOPROPYLPHENYLACETONITRILE

4-ISOPROPYLPHENYLACETONITRILE structure

CAS No:
4395-87-3
Formula:
C11H13N
Chemical Name:
4-ISOPROPYLPHENYLACETONITRILE
Synonyms:
4-ISOPROPYLPHENYLACETONITRILE;2-(4-isopropylphenyl)acetonitrile;4-Isopropylphenylacetonitrile,98+%;4-ISOPROPYLPHENYLACETONITRILE99%;2-(4-propan-2-ylphenyl)ethanenitrile;4-ISOPROPYLBENZYLACETONITRILE,99%;Benzeneacetonitrile,4-(1-methylethyl)-(9CI)
Categories:
Chemical Reagents > Organic Reagents

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4-ISOPROPYLPHENYLACETONITRILE Basic Attributes

Molecular Weight：

159.232

Exact Mass：

159.10500

DSSTox ID：

DTXSID90195999

HScode：

2926909090

Characteristics

PSA：

23.8

XLogP3：

2.87608

Density：

0.960 g/mL at 25 °C(lit.)

Boiling Point：

85-90 °C0.2 atm(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.5125(lit.)

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

wgk germany：

hazard class code：

R20/21/22

safety instructions：

S23-S24/25

Marks：

Precautionary statement(s)：

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

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (83.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:159.23
XLogP3:2.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:159.104799419
Monoisotopic Mass:159.104799419
Topological Polar Surface Area:23.8
Heavy Atom Count:12
Complexity:167
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 4-ISOPROPYLPHENYLACETONITRILE

Compound Net Biotechnology Inc. Contact Supplier

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Manufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acid

4395-87-3 2-(4-propan-2-ylphenyl)acetonitrile

CAS No.: 4395-87-3

Grade: Industrial Grade

Content: 95%

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Guide of 4-ISOPROPYLPHENYLACETONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties
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