Cas no 850593-12-3 (2-Isopropoxy-5-trifluoromethylphenylboronic acid)

2-Isopropoxy-5-trifluoromethylphenylboronic acid structure
850593-12-3 structure
Product Name:2-Isopropoxy-5-trifluoromethylphenylboronic acid
CAS No:850593-12-3
MF:C10H12BF3O3
MW:248.006693840027
MDL:MFCD07363786
CID:716970
PubChem ID:44717207
Update Time:2025-04-19

2-Isopropoxy-5-trifluoromethylphenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (2-Isopropoxy-5-(trifluoromethyl)phenyl)boronic acid
    • (2-Isopropoxy-5-Trifluoromethylphenyl)Boronic Acid
    • 2-Isopropoxy-5-(trifluoromethyl)benzeneboronic acid
    • (2-Isopropoxy-5-(trifluoromethyl)-phenyl)boronic acid
    • [2-isopropoxy-5-(trifluoromethyl)phenyl]boronic acid
    • [2-propan-2-yloxy-5-(trifluoromethyl)phenyl]boronic acid
    • 2-Isopropoxy-5-trifluoromethylphenylboronic acid
    • Boronic acid,B-[2-(1-methylethoxy)-5-(trifluoromethyl)phenyl]-
    • PC1775
    • {2-[(Propan-2-yl)oxy]-5-(trifluoromethyl)phenyl}boronic acid
    • AB30766
    • CHIZGUWFZKIYSO-UHFFFAOYSA-N
    • (2-ISOPROPOXY-5-TRIFLUOROMETHYL)BENZENEBORONIC ACID
    • 2-isopropoxy-5-(trifluoromethyl)phenylboronic acid
    • SCHEMBL12847220
    • DTXSID10660114
    • BS-25892
    • 850593-12-3
    • MFCD07363786
    • F74052
    • DB-015861
    • AKOS015838562
    • MDL: MFCD07363786
    • Inchi: 1S/C10H12BF3O3/c1-6(2)17-9-4-3-7(10(12,13)14)5-8(9)11(15)16/h3-6,15-16H,1-2H3
    • InChI Key: CHIZGUWFZKIYSO-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(=C(B(O)O)C=1)OC(C)C)(F)F

Computed Properties

  • Exact Mass: 248.08300
  • Monoisotopic Mass: 248.083
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 245
  • 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: 1.27
  • Melting Point: 66-68
  • Boiling Point: 343°C at 760 mmHg
  • Flash Point: 161.3°C
  • Refractive Index: 1.465
  • PSA: 49.69000
  • LogP: 1.17240

2-Isopropoxy-5-trifluoromethylphenylboronic acid Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi

2-Isopropoxy-5-trifluoromethylphenylboronic 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-Isopropoxy-5-trifluoromethylphenylboronic acid Pricemore >>

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