Cas no 3696-22-8 (1-(4-Nitrophenyl)-2-thiourea)

1-(4-Nitrophenyl)-2-thiourea structure
1-(4-Nitrophenyl)-2-thiourea structure
Product Name:1-(4-Nitrophenyl)-2-thiourea
CAS No:3696-22-8
MF:C7H7N3O2S
MW:197.214379549026
MDL:MFCD00007304
CID:84841
PubChem ID:253661142
Update Time:2025-04-18

1-(4-Nitrophenyl)-2-thiourea Chemical and Physical Properties

Names and Identifiers

    • 1-(4-nitrophenyl)-2-thiourea
    • 4-Nitrophenylthiourea
    • (4-Nitrophenyl)thiourea
    • N-(4-Nitrophenyl)thiourea
    • 1-(4-nitrophenyl)thiourea
    • (p-Nitrophenyl)thiourea
    • Thiourea, (4-nitrophenyl)-
    • BLYAANPIHFKKMQ-UHFFFAOYSA-N
    • N-(P-Nitrophenyl)Thiourea
    • NSC61006
    • (4-nitro-phenyl)-thiourea
    • N-(4-Nitrophenyl)thiourea #
    • 1-(p-Nitrophenyl)-2-thiourea
    • 1-(4-ni-trophenyl)-2-thiourea
    • 1789AE
    • A
    • SCHEMBL147358
    • AI3-19634
    • 3696-22-8
    • SCHEMBL10741149
    • MFCD00007304
    • BS-42221
    • EINECS 223-021-9
    • 425KZE7SGN
    • Thiourea, N-(4-nitrophenyl)-
    • EN300-50591
    • NSC-61006
    • CS-0287154
    • DTXSID40190454
    • T72375
    • AKOS005206873
    • FT-0619292
    • NS00030132
    • NSC 61006
    • A823482
    • 1-(4-Nitrophenyl)-2-thiourea, 98%
    • N0995
    • DB-018615
    • N-(4-nitro phenyl)thiourea
    • 1-(4-Nitrophenyl)-2-thiourea
    • MDL: MFCD00007304
    • Inchi: 1S/C7H7N3O2S/c8-7(13)9-5-1-3-6(4-2-5)10(11)12/h1-4H,(H3,8,9,13)
    • InChI Key: BLYAANPIHFKKMQ-UHFFFAOYSA-N
    • SMILES: S=C(N)NC1C=CC(=CC=1)[N+](=O)[O-]
    • BRN: 2806574

Computed Properties

  • Exact Mass: 197.02600
  • Monoisotopic Mass: 197.026
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 208
  • 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: 3
  • XLogP3: 1.7
  • Topological Polar Surface Area: 116

Experimental Properties

  • Density: 1.524
  • Melting Point: 206?°C (dec.) (lit.)
  • Boiling Point: 365.5°C at 760 mmHg
  • Flash Point: 174.9°C
  • Refractive Index: 1.759
  • PSA: 115.96000
  • LogP: 2.54680

1-(4-Nitrophenyl)-2-thiourea Security Information

1-(4-Nitrophenyl)-2-thiourea Customs Data

  • HS CODE:2930909090
  • Customs Data:

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. 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:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

1-(4-Nitrophenyl)-2-thiourea Pricemore >>

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