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
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313
[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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