Cas no 25551-28-4 (Naphthalene,diisocyanato-)

Naphthalene,diisocyanato- structure
Naphthalene,diisocyanato- structure
Product Name:Naphthalene,diisocyanato-
CAS No:25551-28-4
MF:C12H6N2O2
MW:210.188242435455
CID:274308
PubChem ID:3033874
Update Time:2025-04-19

Naphthalene,diisocyanato- Chemical and Physical Properties

Names and Identifiers

    • Naphthalene,diisocyanato-
    • NAPHTHALENE DIISOCYANATE
    • 25551-28-4
    • 1,2-diisocyanatonaphthalene
    • Naphthalene, diisoyanato-
    • SCHEMBL38584
    • DTXSID10948449
    • 1, 2-diisocyanatonaphthalene
    • Diisoyanatonaphthalene
    • Naphthalene, diisocyanato-
    • Inchi: 1S/C12H6N2O2/c15-7-13-11-6-5-9-3-1-2-4-10(9)12(11)14-8-16/h1-6H
    • InChI Key: ZXHZWRZAWJVPIC-UHFFFAOYSA-N
    • SMILES: O=C=NC1C(=CC=C2C=CC=CC2=1)N=C=O

Computed Properties

  • Exact Mass: 210.04298
  • Monoisotopic Mass: 210.042927
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 343
  • 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
  • Topological Polar Surface Area: 58.9
  • XLogP3: 4.8

Experimental Properties

  • Density: 1.21
  • Boiling Point: 339.4°Cat760mmHg
  • Flash Point: 139.4°C
  • Refractive Index: 1.618
  • PSA: 58.86
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