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  • ChemicalBook--->CAS DataBase List--->88-65-3

    88-65-3

    88-65-3 Structure

    88-65-3 Structure
    IdentificationMore
    [Name]

    2-Bromobenzoic acid
    [CAS]

    88-65-3
    [Synonyms]

    2-BROMOBENZOIC ACID
    O-BROMOBENZOIC ACID
    RARECHEM AL BO 0014
    2-bromo-benzoicaci
    Benzoic acid, o-bromo-
    benzoicacid,2-bromo-
    bromobenzoicacid
    o-bromo-benzoicaci
    2-Bromobenzoic aicd
    2-Brom-benzoic acid
    Brombenzoicacid,95%
    2-Bromobenzene carboxylic acid
    o-Bromobenzoic Acid 2-Bromobenzoic Acid
    O-BROMOBENZOIC ACID CRYSTALLINE
    2-BROMO BENZOIC ACID FOR SYNTHESIS
    EINECS2
    2-bromobenzoate
    2-Brombenzoesure
    [EINECS(EC#)]

    201-848-6
    [Molecular Formula]

    C7H5BrO2
    [MDL Number]

    MFCD00002402
    [Molecular Weight]

    201.02
    [MOL File]

    88-65-3.mol
    Chemical PropertiesBack Directory
    [Appearance]

    White to light yellow crystal powder
    [Melting point ]

    147-150 °C (lit.)
    [Boiling point ]

    86 °C(Press: 4-5 Torr)
    [density ]

    1,929 g/cm3
    [vapor pressure ]

    >1 mm Hg ( 20 °C)
    [refractive index ]

    1.6080 (estimate)
    [Fp ]

    >100°C
    [storage temp. ]

    Sealed in dry,Room Temperature
    [solubility ]

    95% ethanol: soluble100mg/mL, clear, colorless to yellow
    [form ]

    Powder
    [pka]

    2.84(at 25℃)
    [color ]

    White to light yellow or beige
    [Water Solubility ]

    slightly soluble
    [Detection Methods]

    GC,NMR
    [BRN ]

    971266
    [InChIKey]

    XRXMNWGCKISMOH-UHFFFAOYSA-N
    [CAS DataBase Reference]

    88-65-3(CAS DataBase Reference)
    [NIST Chemistry Reference]

    Benzoic acid, 2-bromo-(88-65-3)
    [EPA Substance Registry System]

    88-65-3(EPA Substance)
    Safety DataBack Directory
    [Hazard Codes ]

    Xi
    [Risk Statements ]

    R36/37/38:Irritating to eyes, respiratory system and skin .
    R36:Irritating to the eyes.
    R37/38:Irritating to respiratory system and skin .
    [Safety Statements ]

    S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
    S36:Wear suitable protective clothing .
    S24/25:Avoid contact with skin and eyes .
    S37/39:Wear suitable gloves and eye/face protection .
    [WGK Germany ]

    3
    [RTECS ]

    DG4448035
    [Hazard Note ]

    Irritant
    [TSCA ]

    Yes
    [HS Code ]

    29163900
    Raw materials And Preparation ProductsBack Directory
    [Raw materials]

    Oxygen-->2-Bromotoluene
    [Preparation Products]

    2-BROMO-5-NITROBENZOIC ACID-->4-CHLORO-2-PHENYLQUINAZOLINE-->2-PHENYL-4-[3H]QUINAZOLINONE-->Triphenylene-->Methyl 2-bromobenzoate-->tert-Butyl 4'-(bromomethyl)biphenyl-2-carboxylate-->2-Bromobenzyl bromide-->Methoxymethyldiphenylamine-->9-Chloroacridine-->Benzoic acid, 2-ethenyl- (9CI)-->2-Bromo-3-nitrobenzoic acid-->2,2'-IMINODIBENZOIC ACID-->2-Biphenylcarboxylic acid-->1(3H)-Isobenzofuranone,3-methyl-(9CI)-->[R-(E)]-alpha-[3-[2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-2-(1-hydroxy-1-methylethyl)benzenepropanol-->5H-Dibenz[b,f]azepine-10,11-dione-->2-(2-Bromophenyl)-2-propanol-->3,3-dimethylphthalide
    Material Safety Data Sheet(MSDS)Back Directory
    [msds information]

    2-Bromobenzoic acid(88-65-3).msds
    Hazard InformationBack Directory
    [Chemical Properties]

    White to light yellow crystal powder
    [Uses]

    2-Bromobenzoic acid was used in the synthesis of new zinc(II) ? 2-bromobenzoate complex compounds. It was used as the starting reagent in the synthesis of hemilabile benzimidazolyl phosphine ligands.
    [Synthesis Reference(s)]

    Canadian Journal of Chemistry, 43, p. 1306, 1965 DOI: 10.1139/v65-178
    The Journal of Organic Chemistry, 59, p. 4042, 1994 DOI: 10.1021/jo00094a007
    [General Description]

    2-Bromobenzoic acid (2-BA) on condensation with aminoquinolines yields phenylquinolylamines. 2-BA is the common building block for synthesis of various nitrogen heterocycles.
    [Purification Methods]

    Crystallise the acid from *C6H6 or MeOH. The anilide has m 141o (from EtOH/H2O). [Beilstein 9 IV 1011.]
    [Toxics Screening Level]

    The ITSL for o-bromobenzoic acid has been changed from 0.04 μg/m3 to 0.1 μg/m3 based on an annual averaging time.
    Spectrum DetailBack Directory
    [Spectrum Detail]

    2-Bromobenzoic acid(88-65-3)MS
    2-Bromobenzoic acid(88-65-3)1HNMR
    2-Bromobenzoic acid(88-65-3)13CNMR
    2-Bromobenzoic acid(88-65-3)IR1
    2-Bromobenzoic acid(88-65-3)IR2
    2-Bromobenzoic acid(88-65-3)Raman
    Well-known Reagent Company Product InformationBack Directory
    [Acros Organics]

    2-Bromobenzoic acid, 97%(88-65-3)
    [Alfa Aesar]

    2-Bromobenzoic acid, 98%(88-65-3)
    [Sigma Aldrich]

    88-65-3(sigmaaldrich)
    [TCI AMERICA]

    2-Bromobenzoic Acid,>98.0%(GC)(T)(88-65-3)
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