Cas no 871332-95-5 ((4-chloro-3-cyanophenyl)boronic acid)

(4-chloro-3-cyanophenyl)boronic acid structure
871332-95-5 structure
Product Name:(4-chloro-3-cyanophenyl)boronic acid
CAS No:871332-95-5
MF:C7H5BClNO2
MW:181.384100675583
MDL:MFCD08056360
CID:69174
PubChem ID:44119831
Update Time:2024-10-26

(4-chloro-3-cyanophenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-Chloro-3-cyanophenyl)boronic acid
    • 4-Chloro-3-cyanobenzeneboronic acid
    • 4-Chloro-3-cyanophenylboronic acid
    • 4-Chloro-3-cyanophenylboronicacid
    • (4-chloro-3-cyano-phenyl)boronic acid
    • PubChem17104
    • KSC447Q0N
    • PRPLADNLEYNYFZ-UHFFFAOYSA-N
    • FCH919650
    • OR9397
    • AM804448
    • B-(4-Chloro-3-cyanophenyl)boronic acid (ACI)
    • Boronic acid, (4-chloro-3-cyanophenyl)- (9CI)
    • SCHEMBL473832
    • Z1201624330
    • 871332-95-5
    • (4-Chloro-3-cyanophenyl)boronicacid
    • EN300-1696853
    • 5-Borono-2-chlorobenzonitrile
    • J-514997
    • AC-33462
    • MFCD08056360
    • DTXSID40657431
    • PB48361
    • PS-9623
    • DB-025118
    • SY022322
    • CS-W008298
    • AKOS006221389
    • (4-chloro-3-cyanophenyl)boronic acid
    • MDL: MFCD08056360
    • Inchi: 1S/C7H5BClNO2/c9-7-2-1-6(8(11)12)3-5(7)4-10/h1-3,11-12H
    • InChI Key: PRPLADNLEYNYFZ-UHFFFAOYSA-N
    • SMILES: N#CC1C(Cl)=CC=C(B(O)O)C=1

Computed Properties

  • Exact Mass: 181.01000
  • Monoisotopic Mass: 181.0101863g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 203
  • 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: 64.2

Experimental Properties

  • Melting Point: 300-304
  • PSA: 64.25000
  • LogP: -0.10852

(4-chloro-3-cyanophenyl)boronic acid Security Information

(4-chloro-3-cyanophenyl)boronic 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-cyanophenyl)boronic acid Pricemore >>

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