benzoylthiocarbimide

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Names

[ CAS No. ]:
532-55-8

[ Name ]:
benzoylthiocarbimide

[Synonym ]:
N-Benzoyl Isothiocyanate
benzoylthiocarbimide
N-(Sulfanylidenemethylene)benzamide
MFCD00004815
EINECS 208-540-0
Isothiocyanic Acid Benzoyl Ester
Benzamide, N-carbonothioyl-
Benzoyl isothiocyanate
Benzoic Acid Anhydride with Isothiocyanic Acid

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
251.7±9.0 °C at 760 mmHg

[ Melting Point ]:
128 °C

[ Molecular Formula ]:
C₈H₅NOS

[ Molecular Weight ]:
163.196

[ Flash Point ]:
106.0±18.7 °C

[ Exact Mass ]:
163.009186

[ PSA ]:
61.52000

[ LogP ]:
2.80

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.586

[ Storage condition ]:
Keep Cold

[ Water Solubility ]:
almost insoluble

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS05, GHS06

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H301-H317-H318

[ Supplemental HS ]:
Contact with acids liberates very toxic gas.

[ Precautionary Statements ]:
P280-P301 + P310-P305 + P351 + P338

[ 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;

[ Risk Phrases ]:
R25;R32;R36;R43

[ Safety Phrases ]:
S26-S36/37-S45-S36/37/39

[ RIDADR ]:
UN 2810 6.1/PG 3

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
29309070

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Potassium thiocyanate
Benzoyl chloride
benzoic acid,tert-butyl-hydroxy-dimethylsilane
triisopropylsilyl benzoate
N-[[3-benzoyl-1-(2,6-dimethylphenyl)-2-sulfanylidene-imidazol-4-yl]thiocarbamoyl]benzamide
Acetyl chloride
benzoic acid
Sodium thiocyanate
trimethylsilyl benzoate

DownStream

1-(3-Methoxy-4-(4-Methyl-1H-imidazol-1-yl)phenyl)thiourea
N-[4-(benzoylcarbamothioylamino)butylcarbamothioyl]benzamide
(4-nitrophenyl)thiourea
1-Methyl-1-phenyl-thiourea
2-MORPHOLIN-4-YL-4-PHENYL-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
N-benzoyl-N'-(2-pyridyl)thiourea
N2-Benzoylguanosine
2,3-dimethylphenylthiourea
Benzamide, N-[(phenylamino)thioxomethyl]-
carbonyl sulfide

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%

Articles

Synthesis of guanosine and its derivatives from 5-amino-1-beta-d-ribofuranoxyl-4-imidazolecarboxamide. I. Ring closure with benzoyl isothiocyanate.

J. Org. Chem. 32(6) , 1825-8, (1967)

Structural, antimicrobial and computational characterization of 1-benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 98 , 290-301, (2012)

A new thiourea derivative, 1-benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea (bcht) has been synthesized from the reaction of 2-amino-4-chlorophenol with benzoyl isothiocyanate. The title compound has be...