3-Ethoxycarbonylphenyl isothiocyanate

Modify Date: 2025-08-27 11:26:51

3-Ethoxycarbonylphenyl isothiocyanate Structure
3-Ethoxycarbonylphenyl isothiocyanate structure
Common Name 3-Ethoxycarbonylphenyl isothiocyanate
CAS Number 3137-84-6 Molecular Weight 207.24900
Density 1.14g/cm3 Boiling Point 335.7ºC at 760mmHg
Molecular Formula C10H9NO2S Melting Point N/A
MSDS N/A Flash Point 156.8ºC

 Names

Name 3-Ethoxycarbonylphenyl isothiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.14g/cm3
Boiling Point 335.7ºC at 760mmHg
Molecular Formula C10H9NO2S
Molecular Weight 207.24900
Flash Point 156.8ºC
Exact Mass 207.03500
PSA 70.75000
LogP 2.59760
Index of Refraction 1.558
InChIKey MCHONYMFRSKTLR-UHFFFAOYSA-N
SMILES CCOC(=O)c1cccc(N=C=S)c1

 Safety Information

Risk Phrases 20/21/22-36/37/38
Safety Phrases 26-36/37/39
RIDADR UN 2810
HS Code 2930909090

 Synthetic Route

~%

3-Ethoxycarbonylphenyl isothiocyanate Structure

3-Ethoxycarbony...

CAS#:3137-84-6

Literature: Journal of the Chemical Society, , p. 440

 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%

 Synonyms

ethyl 3-isothiocyanatobenzoate
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