Cas no 849062-02-8 (5-Bromo-3-ethoxyphenylboronic acid)

5-Bromo-3-ethoxyphenylboronic acid structure
849062-02-8 structure
Product Name:5-Bromo-3-ethoxyphenylboronic acid
CAS No:849062-02-8
MF:C8H10BBrO3
MW:244.878201961517
MDL:MFCD07369739
CID:716674
PubChem ID:24883806
Update Time:2024-10-26

5-Bromo-3-ethoxyphenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (3-Bromo-5-ethoxyphenyl)boronic acid
    • 3-Bromo-5-ethoxyphenylboronic acid
    • 5-Bromo-3-ethoxyphenylboronic acid
    • Boronic acid,B-(3-bromo-5-ethoxyphenyl)-
    • B-(3-Bromo-5-ethoxyphenyl)boronic acid (ACI)
    • Boronic acid, (3-bromo-5-ethoxyphenyl)- (9CI)
    • (3-Bromo-5-ethoxy-phenyl)boronic acid
    • 849062-02-8
    • CS-0101385
    • AB32198
    • (3-Bromo-5-ethoxyphenyl)boronicacid
    • AKOS015834268
    • ZIB06202
    • MFCD07369739
    • BP-11418
    • DTXSID40584637
    • I12592
    • CS-16611
    • MDL: MFCD07369739
    • Inchi: 1S/C8H10BBrO3/c1-2-13-8-4-6(9(11)12)3-7(10)5-8/h3-5,11-12H,2H2,1H3
    • InChI Key: FCUBWEOZVDXVHL-UHFFFAOYSA-N
    • SMILES: BrC1C=C(B(O)O)C=C(OCC)C=1

Computed Properties

  • Exact Mass: 243.99100
  • Monoisotopic Mass: 243.991
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 156
  • 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: 49.7A^2

Experimental Properties

  • Density: 1.53
  • Boiling Point: 376°C at 760 mmHg
  • Flash Point: 181.2°C
  • Refractive Index: 1.567
  • PSA: 49.69000
  • LogP: 0.52760

5-Bromo-3-ethoxyphenylboronic acid Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Safety Instruction: S22; S24/25

5-Bromo-3-ethoxyphenylboronic 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%

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