Cas no 870717-99-0 (3-Bromo-5-methyl-2-methoxyphenylboronic acid)

3-Bromo-5-methyl-2-methoxyphenylboronic acid structure
870717-99-0 structure
Product Name:3-Bromo-5-methyl-2-methoxyphenylboronic acid
CAS No:870717-99-0
MF:C8H10BBrO3
MW:244.878201961517
MDL:MFCD04974110
CID:719160
PubChem ID:24881618
Update Time:2025-04-19

3-Bromo-5-methyl-2-methoxyphenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (3-Bromo-2-methoxy-5-methylphenyl)boronic acid
    • 3-Bromo-5-methyl-2-methoxyphenylboronic acid
    • Boronic acid,B-(3-bromo-2-methoxy-5-methylphenyl)-
    • SCHEMBL3316598
    • 870717-99-0
    • (3-bromo-2-methoxy-5-methylphenyl)boronicacid
    • VJB71799
    • AKOS015834039
    • AB21477
    • MFCD04974110
    • BP-11414
    • D71322
    • CS-0174354
    • DTXSID30400670
    • BS-23069
    • 3-Bromo-5-methyl-2-methoxyphenylboronic&
    • 3-Bromo-2-methoxy-5-methylphenylboronic acid
    • DB-372237
    • MDL： MFCD04974110
    • Inchi： 1S/C8H10BBrO3/c1-5-3-6(9(11)12)8(13-2)7(10)4-5/h3-4,11-12H,1-2H3
    • InChI Key： WHQCYDMSPACJBE-UHFFFAOYSA-N
    • SMILES： BrC1=CC(C)=CC(B(O)O)=C1OC

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: 2
  • Complexity: 168
  • 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: 1.54
  • Melting Point: 102-106?°C (lit.)
  • Boiling Point: 392.5°C at 760 mmHg
  • Flash Point: 191.2°C
  • Refractive Index: 1.569
  • PSA: 49.69000
  • LogP: 0.44590

3-Bromo-5-methyl-2-methoxyphenylboronic acid Security Information

  • Symbol: GHS07
  • Signal Word：Warning
  • Hazard Statement： H315-H319-H335
  • Warning Statement： P261-P305+P351+P338
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Hazard Category Code： 36/37/38
  • Safety Instruction： 36/37
  • Hazardous Material Identification： Xi
  • Risk Phrases：R36/37/38

3-Bromo-5-methyl-2-methoxyphenylboronic 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%

3-Bromo-5-methyl-2-methoxyphenylboronic acid Pricemore >>

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