Cas no 870718-00-6 (3-Bromo-2-ethoxy-5-methylphenylboronic acid)

3-Bromo-2-ethoxy-5-methylphenylboronic acid structure
870718-00-6 structure
Product Name:3-Bromo-2-ethoxy-5-methylphenylboronic acid
CAS No:870718-00-6
MF:C9H12BBrO3
MW:258.904782295227
MDL:MFCD05664336
CID:828025
PubChem ID:24881624
Update Time:2025-04-19

3-Bromo-2-ethoxy-5-methylphenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (3-Bromo-2-ethoxy-5-methylphenyl)boronic acid
    • 3-Bromo-2-ethoxy-5-methylphenylboronic acid
    • 3-BROMO-2-ETHOXYL-5-METHYLPHENYLBORONIC ACID
    • AB22362
    • (3-Bromo-2-ethoxy-5-methylphenyl)boronicacid
    • D71325
    • MFCD05664336
    • SCHEMBL3318902
    • AKOS015834041
    • BS-23057
    • CS-0176042
    • A862907
    • BP-11407
    • 870718-00-6
    • DTXSID90584420
    • 3-BROMO-2-ETHOXY-5-METHYLPHENYLBORONIC &
    • MDL: MFCD05664336
    • Inchi: 1S/C9H12BBrO3/c1-3-14-9-7(10(12)13)4-6(2)5-8(9)11/h4-5,12-13H,3H2,1-2H3
    • InChI Key: BTBLZNZUELXCOT-UHFFFAOYSA-N
    • SMILES: BrC1=CC(C)=CC(B(O)O)=C1OCC

Computed Properties

  • Exact Mass: 258.00600
  • Monoisotopic Mass: 258.006
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 179
  • 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: 1.47
  • Melting Point: 98-102?°C (lit.)
  • Boiling Point: 400.6°C at 760 mmHg
  • Flash Point: 196.1°C
  • Refractive Index: 1.56
  • PSA: 49.69000
  • LogP: 0.83600

3-Bromo-2-ethoxy-5-methylphenylboronic 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-2-ethoxy-5-methylphenylboronic 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-2-ethoxy-5-methylphenylboronic acid Pricemore >>

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abcr
AB271639-5 g
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