Carbethoxy isothiocyanate

Modify Date: 2025-09-01 16:52:34

Carbethoxy isothiocyanate Structure
Carbethoxy isothiocyanate structure
Common Name Carbethoxy isothiocyanate
CAS Number 16182-04-0 Molecular Weight 131.153
Density 1.2±0.1 g/cm3 Boiling Point 155.3±9.0 °C at 760 mmHg
Molecular Formula C4H5NO2S Melting Point N/A
MSDS Chinese USA Flash Point 50.6±0.0 °C
Symbol GHS02 GHS06 GHS08
GHS02, GHS06, GHS08
Signal Word Danger

 Names

Name Ethoxycarbonyl Isothiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 155.3±9.0 °C at 760 mmHg
Molecular Formula C4H5NO2S
Molecular Weight 131.153
Flash Point 50.6±0.0 °C
Exact Mass 131.004105
PSA 70.75000
LogP 2.03
Vapour Pressure 3.1±0.3 mmHg at 25°C
Index of Refraction 1.504
Storage condition 2-8°C

 Safety Information

Symbol GHS02 GHS06 GHS08
GHS02, GHS06, GHS08
Signal Word Danger
Hazard Statements H226-H315-H317-H319-H331-H334-H335
Precautionary Statements P261-P280-P305 + P351 + P338-P311
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes T: Toxic;Xi: Irritant;
Risk Phrases R23;R36/37/38;R42
Safety Phrases S23-S26-S36/37/39-S45
RIDADR UN 2929 6.1/PG 2
WGK Germany 3
Packaging Group III
Hazard Class 3
HS Code 2930909090

 Synthetic Route

~%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Journal of Heterocyclic Chemistry, , vol. 19, p. 1457 - 1459

~97%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Dow AgroSciences LLC; Fisk, Jason S.; Bland, Douglas C.; Frycek, George J. Patent: US2014/100381 A1, 2014 ; Location in patent: Page/Page column ;

~73%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Gensler, Walter J.; Chan, Sum; Ball, David B. Journal of Organic Chemistry, 1981 , vol. 46, # 17 p. 3407 - 3415

~%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: US4778921 A1, ;

~%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: US4020095 A1, ;

~49%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Bunnenberg, Rolf; Jochims, Johannes C. Chemische Berichte, 1981 , vol. 114, # 5 p. 1746 - 1751

~%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Journal of the Chemical Society, , vol. 69, p. 329

~%

Carbethoxy isothiocyanate Structure

Carbethoxy isot...

CAS#:16182-04-0

Literature: Zeitschrift fuer Naturforschung, Teil B: Anorganische Chemie, Organische Chemie, , vol. 38, # 6 p. 764 - 768

 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%

 Articles6

More Articles
Structure-based design, synthesis, and study of pyrazolo[1,5-a][1,3,5]triazine derivatives as potent inhibitors of protein kinase CK2.

Bioorg. Med. Chem. Lett. 17(15) , 4191-5, (2007)

The structure-based design, synthesis, and anticancer activity of novel inhibitors of protein kinase CK2 are described. Using pyrazolo[1,5-a][1,3,5]triazine as the core scaffold, a structure-guided se...

J. Org. Chem. 58 , 7022, (1993)

Heterocycles 36 , 2465, (1993)

 Synonyms

Ethoxycarbonyl isothiocyanate
MFCD00004814
Isothiocyanatoformic acid ethyl
Carbonisothiocyanatidic acid, ethyl ester
Isothiocyanatoformic Acid Ethyl Ester
Carbethoxy isothiocyanate
ethyl isothiocyanoformate
Ethoxycarbonyl Mustard Oil
CARBETHOXYISOTHIOCYANATE
Ethyl Isothiocyanatoformate
Ethyl isothiocyanatidocarbonate
ethoxycarbonyl-isothiocyanate
EINECS 240-318-9
Ethyl carbonisothiocyanatidate
(Ethoxyoxomethyl) isothiocyanate
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