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4-Cyanophenyl isothiocyanate

4-Cyanophenyl isothiocyanate structure

CAS No:
2719-32-6
Formula:
C8H4N2S
Chemical Name:
4-Cyanophenyl isothiocyanate
Synonyms:
Benzonitrile,4-isothiocyanato-;Isothiocyanic acid,p-cyanophenyl ester;4-Isothiocyanatobenzonitrile;p-Cyanophenyl isothiocyanate;4-Cyanophenyl isothiocyanate;28176-29-6
Categories:
Chemical Reagents > Organic Reagents

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Description

light yellow to beige crystalline powder

4-Cyanophenyl isothiocyanate Basic Attributes

Molecular Weight：

160.2

Exact Mass：

160.20

BRN：

2802621

EC Number：

220-323-2

DSSTox ID：

DTXSID3062609

HScode：

2930909090

Characteristics

PSA：

68.2

XLogP3：

3.18

Density：

1.1±0.1 g/cm3

Melting Point：

121 °C

Boiling Point：

314.7±25.0 °C at 760 mmHg

Flash Point：

144.1±23.2 °C

Refractive Index：

1.604

Storage Conditions：

Keep Cold

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 2811 6.1/PG 3

wgk germany：

hazard class code：

safety instructions：

26-27-36/37/39-45

RTECS Number：

NX8479500

Marks：

Hazard note：

Corrosive/Lachrymatory/Keep cold

Precautionary statement(s)：

P280-P305 + P351 + P338-P310

Hazard Statements：

H314

GHS Classification：

|Danger|H302 (11.11%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P264, P270, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Cyanophenyl isothiocyanate Use and Manufacturing

Uses

p-Cyanophenyl Isothiocyanate is an synthetic isothiocyanate derivative with potential anti-NF-kB and anti-inflammatory activities.

Manufacturing Info：

Benzonitrile, 4-isothiocyanato-: ACTIVE

Computed Properties

Molecular Weight:160.20
XLogP3:3.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:160.00951931
Monoisotopic Mass:160.00951931
Topological Polar Surface Area:68.2
Heavy Atom Count:11
Complexity:214
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-CYANOPHENYL ISOTHIOCYANATE 99% high purity certified Professional producer Greenbo

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Guide of 4-Cyanophenyl isothiocyanate

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

4-Cyanophenyl isothiocyanate

SDS

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