Cas no 897958-93-9 ((2,5-difluoro-4-methoxy-phenyl)boronic acid)

(2,5-difluoro-4-methoxy-phenyl)boronic acid structure
897958-93-9 structure
Product Name:(2,5-difluoro-4-methoxy-phenyl)boronic acid
CAS No:897958-93-9
MF:C7H7BF2O3
MW:187.936489343643
MDL:MFCD04038754
CID:714995
Update Time:2024-01-31

(2,5-difluoro-4-methoxy-phenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (2,5-Difluoro-4-methoxyphenyl)boronic acid
    • 2,5-Difluoro-4-methoxyphenylboronic acid
    • Boronic acid,B-(2,5-difluoro-4-methoxyphenyl)-
    • (2,5-difluoro-4-methoxy-phenyl)boronic acid
    • 2,5-Difluoro-4-methoxybenzeneboronic acid 98%
    • Boronic acid, B-(2,5-difluoro-4-methoxyphenyl)-
    • MDL: MFCD04038754
    • Inchi: 1S/C7H7BF2O3/c1-13-7-3-5(9)4(8(11)12)2-6(7)10/h2-3,11-12H,1H3
    • InChI Key: BRMUXDWCSVTVPQ-UHFFFAOYSA-N
    • SMILES: B(C1=CC(F)=C(OC)C=C1F)(O)O

Computed Properties

  • Exact Mass: 188.04600
  • Monoisotopic Mass: 188.046
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 170
  • 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: 1.35
  • Melting Point: >246°C (dec.)
  • Boiling Point: 301.3±52.0℃ at 760 mmHg
  • Flash Point: 136°C
  • Refractive Index: 1.485
  • Solubility: Soluble in DMSO (a little) \ methanol (a little)
  • PSA: 49.69000
  • LogP: -0.34680
  • pka: 7.67±0.58(Predicted)

(2,5-difluoro-4-methoxy-phenyl)boronic acid Security Information

  • Hazard Category Code: 25
  • Safety Instruction: 45
  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT
  • Storage Condition:2-8°C

(2,5-difluoro-4-methoxy-phenyl)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%

(2,5-difluoro-4-methoxy-phenyl)boronic acid Pricemore >>

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