2-(METHOXYCARBONYL)PHENYL ISOCYANATE Chemical Properties

Melting point:

45-49 °C (lit.)

Boiling point:

101 °C/2 mmHg (lit.)

Density 

1.15±0.1 g/cm3 (20 ºC 760 Torr)

refractive index 

1.5200 (estimate)

Flash point:

145-146°C/16mm

form 

Solid or Crystalline Solid

color 

White to off-white

Water Solubility 

Hydrolyzes in water.

Sensitive 

Moisture Sensitive

BRN 

1241370

InChI

1S/C9H7NO3/c1-13-9(12)7-4-2-3-5-8(7)10-6-11/h2-5H,1H3

InChIKey

ATFKBWNEVZUSKC-UHFFFAOYSA-N

SMILES

COC(=O)c1ccccc1N=C=O

Safety Information

Hazard Codes 

Xn,Xi

Risk Statements 

20/21/22-36/37/38

Safety Statements 

26-27-37/39

RIDADR 

2811

WGK Germany 

3

HazardClass 

6.1

PackingGroup 

III

Storage Class

11 - Combustible Solids

Hazard Classifications

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3

MSDS

• Language:English Provider:SigmaAldrich
• Language:English Provider:ALFA

2-(METHOXYCARBONYL)PHENYL ISOCYANATE Usage And Synthesis

Uses

Methyl 2-isocyanatobenzoate may be used for the following syntheses:

• 3H-quinazolin-4-ones
• A1120, a high affinity (K_i = 8.3nM) non-retinoid ligand for the Retinol-binding protein
• trans- and cis-N-phenyl-N′-(4-phenoxy)cyclohexylureas

2-(METHOXYCARBONYL)PHENYL ISOCYANATE(1793-07-3)Related Product Information

• Phenyl isocyanate
• 3-(METHOXYCARBONYL)PHENYL ISOCYANATE
• 3,5-BIS(METHOXYCARBONYL)PHENYL ISOCYANATE,3,5-BIS(METHOXYCARBONYL)PHENYL ISOCYANATE 98%
• Methyl anthranilate
• 2-(N-BUTOXYCARBONYL)PHENYL ISOCYANATE
• ETHYL 2-ISOCYANATOBENZOATE
• 2-(METHOXYCARBONYL)PHENYL ISOCYANATE
• 2-Methylphenyl isocyanate
• dimethyl 2-isocyanatoterephthalate