Cas no 2505-31-9 (2,4,6-Trichlorophenyl isocyanate)

2,4,6-Trichlorophenyl isocyanate structure
2505-31-9 structure
Product Name:2,4,6-Trichlorophenyl isocyanate
CAS No:2505-31-9
MF:C7H2Cl3NO
MW:222.455878734589
MDL:MFCD00013845
CID:84365
PubChem ID:87571909
Update Time:2025-04-18

2,4,6-Trichlorophenyl isocyanate Chemical and Physical Properties

Names and Identifiers

    • 2,4,6-trichlorophenyl isocyanate
    • Isocyanic acid 2,4,6-trichlorophenyl ester
    • 1,3,5-trichloro-2-isocyanatobenzene
    • 2,3-DIHYDROBENZO
    • 2,4,6-trichlorobenzenisocyanate
    • 2,4,6-Trichlor-phenylisocyanat
    • 2.4.6-Trichlor-1-isocyanato-benzol
    • VDYWXVDWKFAUKE-UHFFFAOYSA-N
    • 2,4,6-Trichlorophenylisocyanate
    • 2,4,6-trichlorphenylisocyanat
    • 2,4,6trichlorophenyl isocyanate
    • SBB096360
    • 1,3,5-Trichloro-2-isocyanatobenzene #
    • ZB008348
    • ST50825735
    • F
    • 2505-31-9
    • BS-43959
    • 1, 3, 5-trichloro-2-isocyanatobenzene
    • ISOCYANIC ACID 2,4,6-TRICHLOROPHENYL ESTER 96+%
    • MFCD00013845
    • SCHEMBL1019709
    • I0565
    • FT-0609853
    • EN300-271051
    • DTXSID20346614
    • T72162
    • AKOS009158986
    • Benzene, 1,3,5-trichloro-2-isocyanato-
    • CAA50531
    • DB-046609
    • DTXCID10297686
    • 2,4,6-Trichlorophenyl isocyanate
    • MDL： MFCD00013845
    • Inchi： 1S/C7H2Cl3NO/c8-4-1-5(9)7(11-3-12)6(10)2-4/h1-2H
    • InChI Key： VDYWXVDWKFAUKE-UHFFFAOYSA-N
    • SMILES： ClC1C=C(C=C(C=1N=C=O)Cl)Cl
    • BRN： 514678

Computed Properties

  • Exact Mass: 220.92000
  • Monoisotopic Mass: 220.92
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 193
  • 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: 4.6
  • Topological Polar Surface Area: 29.4

Experimental Properties

  • Color/Form: White solid
  • Density: 1.51
  • Melting Point: 65.0 to 69.0 deg-C
  • Boiling Point: 101°C/2mmHg(lit.)
  • Flash Point: 101°C/2mm
  • Refractive Index: 1.597
  • PSA: 29.43000
  • LogP: 3.61410
  • Sensitiveness: Moisture Sensitive
  • Solubility: Hydrolyzable

2,4,6-Trichlorophenyl isocyanate Security Information

2,4,6-Trichlorophenyl isocyanate Customs Data

  • HS CODE：2929109000
  • Customs Data：

    China Customs Code:

    2929109000

    Overview:

    2929109000. Other isocyanates. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

2,4,6-Trichlorophenyl isocyanate Pricemore >>

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