23138-53-6

Name METHYL 4-ISOCYANATOBENZOATE 98
CAS 23138-53-6
Molecular Formula C9H7NO3
MDL Number MFCD01863690
Molecular Weight 177.16
MOL File 23138-53-6.mol

Chemical Properties

Melting point  50-52 °C (lit.)
Boiling point  122-124 °C(Press: 11 Torr)
density  1.15±0.1 g/cm3(Predicted)
Fp  >230 °F
storage temp.  2-8°C
InChI 1S/C9H7NO3/c1-13-9(12)7-2-4-8(5-3-7)10-6-11/h2-5H,1H3
InChIKey FQDDBYGPHUUTRN-UHFFFAOYSA-N
SMILES COC(=O)c1ccc(cc1)N=C=O

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
RIDADR  UN 3335
WGK Germany  3
HazardClass  IRRITANT
HS Code  2929100090
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

Hazard Information

Supplier