3-cyanophenyl isothiocyanate

Modify Date: 2024-01-02 16:31:12

3-cyanophenyl isothiocyanate Structure
3-cyanophenyl isothiocyanate structure
Common Name 3-cyanophenyl isothiocyanate
CAS Number 3125-78-8 Molecular Weight 160.19600
Density 1.12g/cm3 Boiling Point 303.1ºC at 760mmHg
Molecular Formula C8H4N2S Melting Point 64-66 °C(lit.)
MSDS Chinese USA Flash Point 137.1ºC
Symbol GHS05 GHS07 GHS08
GHS05, GHS07, GHS08
Signal Word Danger

 Names

Name 3-isothiocyanatobenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.12g/cm3
Boiling Point 303.1ºC at 760mmHg
Melting Point 64-66 °C(lit.)
Molecular Formula C8H4N2S
Molecular Weight 160.19600
Flash Point 137.1ºC
Exact Mass 160.01000
PSA 68.24000
LogP 2.29258
Index of Refraction 1.604
Storage condition Keep Cold

 Safety Information

Symbol GHS05 GHS07 GHS08
GHS05, GHS07, GHS08
Signal Word Danger
Hazard Statements H302-H312-H314-H317-H332-H334
Precautionary Statements P261-P280-P305 + P351 + P338-P310
Personal Protective Equipment Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard Codes C: Corrosive;T: Toxic;
Risk Phrases R23/24/25;R36/37/38
Safety Phrases S22-S26-S36/37/39-S45
RIDADR UN 1759 8/PG 3
WGK Germany 3
Packaging Group III
Hazard Class 8
HS Code 2930909090

 Precursor & DownStream

Precursor  0

DownStream  1

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Articles3

More Articles
Preparation of aryl isothiocyanates via protected phenylthiocarbamates and application to the synthesis of caffeic acid (4-isothiocyanato)phenyl ester.

J. Org. Chem. 65(19) , 6237-40, (2000)

Yaws CL.

The Yaws Handbook of Physical Properties for Hydrocarbons and Chemicals 2nd ed.,, (2015), 178

Copper-catalyzed synthesis of 3-substituted-5-amino-1,2,4-thiadiazoles via intramolecular N-S bond formation. Kim HY, et al.

Tetrahedron 70(45) , 8737-8743, (2014)

 Synonyms

3-Cyanophenyl isothiocyanate
MFCD00041070
m-Cyanophenyl isothiocyanate
Benzonitrile,3-isothiocyanato
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