Cas no 81606-47-5 (2-(3-Bromophenyl)-2-methylpropanoic acid)

2-(3-Bromophenyl)-2-methylpropanoic acid structure
81606-47-5 structure
Product Name:2-(3-Bromophenyl)-2-methylpropanoic acid
CAS No:81606-47-5
MF:C10H11BrO2
MW:243.097142457962
MDL:MFCD11036929
CID:856868
PubChem ID:12805128
Update Time:2024-10-27

2-(3-Bromophenyl)-2-methylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(3-BROMOPHENYL)-2-METHYLPROPANOIC ACID
    • 2-(3-Bromophenyl)-2-methylpropionic acid
    • OTAVA-BB 1287281
    • 3-Bromo-α,α-dimethylbenzeneacetic acid (ACI)
    • DTXSID90510289
    • J-505763
    • 81606-47-5
    • 2-(3-Bromophenyl)-2-methylpropanoicAcid
    • MFCD11036929
    • CS-0046057
    • 2-(3-bromo-phenyl)-2-methyl-propionic acid
    • EN300-64755
    • XH0614
    • SY031208
    • AKOS010213745
    • SCHEMBL826639
    • Z725146472
    • PZQVCFYGWRPVLE-UHFFFAOYSA-N
    • 2-(3-Bromophenyl)-2-methylpropanoic acid
    • MDL: MFCD11036929
    • Inchi: 1S/C10H11BrO2/c1-10(2,9(12)13)7-4-3-5-8(11)6-7/h3-6H,1-2H3,(H,12,13)
    • InChI Key: PZQVCFYGWRPVLE-UHFFFAOYSA-N
    • SMILES: O=C(C(C)(C)C1C=C(Br)C=CC=1)O

Computed Properties

  • Exact Mass: 241.99400
  • Monoisotopic Mass: 241.99424g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 201
  • 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
  • XLogP3: 3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.5±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 310.8±17.0 °C at 760 mmHg
  • Flash Point: 141.8±20.9 °C
  • PSA: 37.30000
  • LogP: 2.81130
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C

2-(3-Bromophenyl)-2-methylpropanoic acid Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2-(3-Bromophenyl)-2-methylpropanoic acid Pricemore >>

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