Cas no 871332-68-2 (4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid)

4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid structure
871332-68-2 structure
Product Name:4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid
CAS No:871332-68-2
MF:C11H15BClNO3
MW:255.505702257156
MDL:MFCD07363797
CID:719312
PubChem ID:44886931
Update Time:2025-09-23

4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-Chloro-3-(diethylcarbamoyl)phenyl)boronic acid
    • 4-Chloro-3-(diethylcarbamoyl)benzeneboronic acid
    • [4-chloro-3-(diethylcarbamoyl)phenyl]boronic acid
    • 4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid
    • Boronic acid,B-[4-chloro-3-[(diethylamino)carbonyl]phenyl]-
    • CS-0174759
    • I12365
    • A853773
    • (4-Chloro-3-(diethylcarbamoyl)phenyl)boronicacid
    • AB30790
    • 871332-68-2
    • AKOS015849967
    • AM87295
    • MFCD07363797
    • 4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronicacid
    • BS-25854
    • DTXSID80661219
    • MDL: MFCD07363797
    • Inchi: 1S/C11H15BClNO3/c1-3-14(4-2)11(15)9-7-8(12(16)17)5-6-10(9)13/h5-7,16-17H,3-4H2,1-2H3
    • InChI Key: JLDCVUGASMQNGS-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(B(O)O)C=C1C(N(CC)CC)=O

Computed Properties

  • Exact Mass: 255.08300
  • Monoisotopic Mass: 255.083
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 261
  • 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
  • Topological Polar Surface Area: 60.8A^2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Melting Point: 130-134℃
  • Boiling Point: 467.5±55.0 °C at 760 mmHg
  • Flash Point: 236.5±31.5 °C
  • PSA: 60.77000
  • LogP: 0.50180
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid Security Information

4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid Customs Data

  • HS CODE:2931900090
  • Customs Data:

    China Customs Code:

    2931900090

    Overview:

    2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%

    Summary:

    2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

4-Chloro-3-(N,N-diethylcarbamoyl)phenylboronic acid Pricemore >>

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