3-(ethoxycarbonyl)phenyl isocyanate

Names

[ Name ]:
3-(ethoxycarbonyl)phenyl isocyanate

[Synonym ]:
m-carboethoxyphenyl isocyanate
3-Carbethoxyphenyl isocyanate
3-Carboethoxyphenyl isocyanate
MFCD00013865
3-isocyanatobenzoic acid ethyl ester
3-ethoxycarbonylphenyl isocyanate

Chemical & Physical Properties

[ Density]:
1.154 g/mL at 25 °C(lit.)

[ Boiling Point ]:
213 °C(lit.)

[ Molecular Formula ]:
C₁₀H₉NO₃

[ Molecular Weight ]:
191.18300

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
191.05800

[ PSA ]:
55.73000

[ LogP ]:
1.83060

[ Index of Refraction ]:
n20/D 1.531(lit.)

[ Storage condition ]:
2-8°C

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H312-H315-H319-H332-H334-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338-P342 + P311

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R20/22;R36/37/38;R42

[ Safety Phrases ]:
S26-S27-S37/39

[ RIDADR ]:
2206

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2929109000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2929109000

[ Summary ]:
2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Discovery of piperidine-aryl urea-based stearoyl-CoA desaturase 1 inhibitors.

Bioorg. Med. Chem. Lett. 18(15) , 4298-302, (2008)

A series of structurally novel stearoyl-CoA desaturase1 (SCD1) inhibitors has been identified via molecular scaffold manipulation. Preliminary structure-activity relationship (SAR) studies led to the ...