Cas no 9017-01-0 (Benzene,1,3-diisocyanatomethyl-, homopolymer)

Benzene,1,3-diisocyanatomethyl-, homopolymer structure
9017-01-0 structure
Product Name:Benzene,1,3-diisocyanatomethyl-, homopolymer
CAS No:9017-01-0
MF:C9H6N2O2
MW:174.156141757965
CID:808917
Update Time:2024-02-02

Benzene,1,3-diisocyanatomethyl-, homopolymer Chemical and Physical Properties

Names and Identifiers

    • Benzene,1,3-diisocyanatomethyl-, homopolymer
    • 1,3-Diisocyanato-2-methylbenzene
    • Isocyanicacid, methyl-m-phenylene ester, polymers (8CI)
    • 1,3-Diisocyanatomethylbenzenehomopolymer
    • Methyl-m-phenylene isocyanate polymer
    • Poly(toluene diisocyanate)
    • Poly(tolylene diisocyanate)
    • TDI homopolymer
    • TDI polymer
    • Toluene diisocyanatehomopolymer
    • Toluene diisocyanate polymer
    • Tolylene diisocyanate homopolymer
    • Tolylene diisocyanate polymer
    • Benzene, 1,3-diisocyanatomethyl-, homopolymer
    • Benzene, 1,3-diisocyanatomethyl-, homopolymer Toluene diisocyanate polymer Tolylene diisocyanate, homopolymer 1,3-diisocyanatomethyl-benzen homopolymer Benzene,1,3-diisocyanatomethyl-,homopolymer
    • 1,3-DIISOCYANATOMETHYLBENZENE HOMOPOLYMER
    • toluene diisocyanate homopolymer
    • Inchi: 1S/C9H6N2O2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13/h2-4H,1H3
    • InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N
    • SMILES: C1(N=C=O)=CC=CC(N=C=O)=C1C

Computed Properties

  • Exact Mass: 174.042927
  • Monoisotopic Mass: 174.042927
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 239
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3.9
  • Topological Polar Surface Area: 58.9

Experimental Properties

  • Density: 6
  • Melting Point: 18.3 deg C
  • Boiling Point: 248.4°Cat760mmHg
  • Flash Point: 110.5°C
  • Refractive Index: Index of refraction: 1.5708 at 20 °C/D
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