Cas no 65069-55-8 ((2H-1,3-benzodioxol-5-yl)thiourea)

(2H-1,3-benzodioxol-5-yl)thiourea structure
65069-55-8 structure
Product Name:(2H-1,3-benzodioxol-5-yl)thiourea
CAS No:65069-55-8
MF:C8H8N2O2S
MW:196.226320266724
MDL:MFCD00041216
CID:502703
PubChem ID:1471599
Update Time:2025-04-19

(2H-1,3-benzodioxol-5-yl)thiourea Chemical and Physical Properties

Names and Identifiers

    • Thiourea,N-1,3-benzodioxol-5-yl-
    • 1-(3,4-Methylenedioxyphenyl)-2-thiourea
    • 1,3-benzodioxol-5-ylthiourea
    • Benzo[1,3]dioxol-5-yl-thiourea
    • 3,4-Methylenedioxyphenylthiourea
    • A834963
    • SMR000336214
    • SCHEMBL788729
    • EN300-79680
    • DTXSID10362989
    • 1-(3,4-Methylenedioxyphenyl)-2-thiourea, AldrichCPR
    • MFCD00041216
    • Z291278954
    • 65069-55-8
    • FEDOVBDZDYIYDD-UHFFFAOYSA-N
    • HMS2721M20
    • 2N-008
    • (1,3-dioxaindan-5-yl)thiourea
    • N-(1,3-benzodioxol-5-yl)thiourea
    • (2H-1,3-benzodioxol-5-yl)thiourea
    • CHEMBL1344040
    • AKOS009156267
    • FT-0682104
    • N-2H-1,3-Benzodioxol-5-ylthiourea
    • MLS000763351
    • 1-(Benzo[d][1,3]dioxol-5-yl)thiourea
    • 1-(1,3-benzodioxol-5-yl)thiourea
    • DB-018485
    • 2h-1,3-benzodioxol-5-ylthiourea
    • MDL： MFCD00041216
    • Inchi： 1S/C8H8N2O2S/c9-8(13)10-5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H3,9,10,13)
    • InChI Key： FEDOVBDZDYIYDD-UHFFFAOYSA-N
    • SMILES： S=C(N)NC1C=CC2=C(C=1)OCO2

Computed Properties

  • Exact Mass: 196.03100
  • Monoisotopic Mass: 196.031
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 212
  • 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: 0.8
  • Topological Polar Surface Area: 88.6A^2

Experimental Properties

  • Density: 1.524
  • Melting Point: 198 °C
  • Boiling Point: 329.6 °C at 760 mmHg
  • Flash Point: 153.2 °C
  • Refractive Index: 1.757
  • PSA: 88.60000
  • LogP: 1.84410

(2H-1,3-benzodioxol-5-yl)thiourea Security Information

  • HazardClass：IRRITANT

(2H-1,3-benzodioxol-5-yl)thiourea 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%

(2H-1,3-benzodioxol-5-yl)thiourea Pricemore >>

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abcr
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