Cas no 452929-54-3 (4-Bromo-4'-cyanobenzophenone)

4-Bromo-4'-cyanobenzophenone structure
4-Bromo-4'-cyanobenzophenone structure
Product Name:4-Bromo-4'-cyanobenzophenone
CAS No:452929-54-3
MF:C14H8BrNO
MW:286.123422622681
MDL:MFCD00672021
CID:929873
PubChem ID:20334239
Update Time:2025-04-19

4-Bromo-4'-cyanobenzophenone Chemical and Physical Properties

Names and Identifiers

    • 4-(4-bromobenzoyl)benzonitrile
    • 4-Bromo-4\'-cyanobenzophenone
    • 4-broMo-4'-cyanobenzophenone
    • MFCD00672021
    • DTXSID30605608
    • 452929-54-3
    • CS-0360086
    • AC6163
    • CTA92954
    • SY247576
    • SCHEMBL4811505
    • AKOS016017773
    • 4-Bromo-4'-cyanobenzophenone
    • MDL: MFCD00672021
    • Inchi: 1S/C14H8BrNO/c15-13-7-5-12(6-8-13)14(17)11-3-1-10(9-16)2-4-11/h1-8H
    • InChI Key: YRVOJWYIXLYAEO-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)C(C1C=CC(C#N)=CC=1)=O

Computed Properties

  • Exact Mass: 284.97900
  • Monoisotopic Mass: 284.97893g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 316
  • 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: 3.6
  • Topological Polar Surface Area: 40.9?2

Experimental Properties

  • Density: 1.53
  • Boiling Point: 425.4°C at 760 mmHg
  • Flash Point: 211.1°C
  • Refractive Index: 1.655
  • PSA: 40.86000
  • LogP: 3.55178

4-Bromo-4'-cyanobenzophenone Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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