Cas no 368869-87-8 (3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate)

3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate structure
368869-87-8 structure
Product Name:3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate
CAS No:368869-87-8
MF:C10H9NO3
MW:191.183362722397
MDL:MFCD02681909
CID:303541
PubChem ID:2776391
Update Time:2025-04-19

3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate Chemical and Physical Properties

Names and Identifiers

    • 2H-1,5-Benzodioxepin,3,4-dihydro-7-isocyanato-
    • 3,4-dihydro-2H-1,5-benzodioxepin-7-yl isocyanate
    • 7-isocyanato-3,4-dihydro-2H-1,5-benzodioxepine
    • FT-0614304
    • AKOS009158179
    • 7-isocyanato-3,4-dihydro-2H-benzo[b][1,4]dioxepine
    • MFCD02681909
    • J-511168
    • 368869-87-8
    • SCHEMBL1019756
    • 3,4-Dihydro-2h-1,5-benzodioxepin-7-ylisocyanate
    • BS-28179
    • A823434
    • DTXSID20380038
    • DB-021897
    • 3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate
    • MDL: MFCD02681909
    • Inchi: 1S/C10H9NO3/c12-7-11-8-2-3-9-10(6-8)14-5-1-4-13-9/h2-3,6H,1,4-5H2
    • InChI Key: DUCMKSIKRPVTAJ-UHFFFAOYSA-N
    • SMILES: O1C2C=C(C=CC=2OCCC1)N=C=O

Computed Properties

  • Exact Mass: 191.05800
  • Monoisotopic Mass: 191.058
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 238
  • 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
  • XLogP3: 2.6
  • Topological Polar Surface Area: 47.9?2

Experimental Properties

  • Density: 1.26
  • Boiling Point: 302.2°C at 760 mmHg
  • Flash Point: 146.5°C
  • Refractive Index: 1.577
  • PSA: 47.89000
  • LogP: 1.81520

3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate Security Information

3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate Customs Data

  • HS CODE:2932999099
  • Customs Data:

    China Customs Code:

    2932999099

    Overview:

    2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3,4-Dihydro-2h-1,5-benzodioxepin-7-yl isocyanate Pricemore >>

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abcr
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abcr
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