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CAS Number: 16182-04-0
O-ethyl carbonisothiocyanatidate

Structure

O-ethyl carbonisothiocyanatidate
Name: O-ethyl carbonisothiocyanatidate
Synonyms:
General Information
Product Number: 16182040

CAS Registry Number 16182-04-0
Name:
Carbon(isothiocyanat​idic) acid, ethyl ester
Carbonic acid, ethyl ester, anhydride with isothiocyanic acid (7CI)
Carbonic acid, monoanhydride with isothiocyanic acid, ethyl ester (8CI)
Carbethoxyisothiocyanate
Carbonic acid ethyl ester isothiocyanate
Ethoxycarbonyl isothiocyanate

 

Chemical Formula: C4H5NO2S
Exact Mass: 131.00
Molecular Weight: 131.15
m/z: 131.00 (100.0%), 133.00 (4.5%), 132.01 (4.5%), 132.00 (1.2%)

 

InChI:InChI=1S/C4H5NO2S/c1-2-7-4(6)5-3-8/h2H2,1H3

InChI Key:BDTDECDAHYOJRO-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)N=C=S

Specification

98%

References
  1. (4) Takamizawa, Akira; Bulletin of the Chemical Society of Japan 1963, V36(9), P1214-20 CAPLUS
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