Return to Results Toluene 2,6-diisocyanate
CAS Registry Number®
91-08-7
CAS Name
Toluene 2,6-diisocyanateMolecular Formula
C9H6N2O2Molecular Mass
174.16Cite this Page
Toluene 2,6-diisocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=91-08-7 (retrieved ) (CAS RN: 91-08-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
129-133 °C @ Press: 18 TorrMelting Point (1)
18.3 °CDensity (1)
1.22 g/cm³
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C9H6N2O2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13/h2-4H,1H3
InChIKey
InChIKey=RUELTTOHQODFPA-UHFFFAOYSA-N
SMILES
N(=C=O)C1=C(C)C(N=C=O)=CC=C1
Canonical SMILES
O=C=NC1=CC=CC(N=C=O)=C1C
Other Names for this Substance
- Benzene, 1,3-diisocyanato-2-methyl-
- Isocyanic acid, 2-methyl-m-phenylene ester
- 1,3-Diisocyanato-2-methylbenzene
- 2,6-Diisocyanatotoluene
- m-Tolylene diisocyanate
Deleted or Replaced CAS Registry Numbers
137091-34-0
