ChemicalBook--->CAS DataBase List--->18698-97-0

18698-97-0

18698-97-0 Structure

18698-97-0 Structure
IdentificationMore
[Name]

2-Bromophenylacetic acid
[CAS]

18698-97-0
[Synonyms]

2-BROMOPHENYLACETIC ACID
LABOTEST-BB LT00454446
O-BROMOPHENYLACETIC ACID
RARECHEM AL BO 0109
TIMTEC-BB SBB006626
2-Bromophenylacetic acid, 98+%
Benzeneacetic acid, 2-bromo-
2-(2-Bromophenyl)acetic acid
2-BROMOPHENYLACETIC ACID 98.5+%
omophenylacetic acid
2-Bromobenzeneacetic acid
o-Bromobenzeneacetic acid
[EINECS(EC#)]

242-509-2
[Molecular Formula]

C8H7BrO2
[MDL Number]

MFCD00004314
[Molecular Weight]

215.04
[MOL File]

18698-97-0.mol
Chemical PropertiesBack Directory
[Appearance]

almost white to light beige crystals or powder
[Melting point ]

104-106 °C(lit.)
[Boiling point ]

252.95°C (rough estimate)
[density ]

1.5313 (rough estimate)
[refractive index ]

1.5500 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Very faint turbidity in methanol.
[form ]

Crystalline Powder, Crystals and/or Chunks
[pka]

pK1: 4.054 (25°C)
[color ]

White to light beige
[BRN ]

2250655
[InChI]

InChI=1S/C8H7BrO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11)
[InChIKey]

DWXSYDKEWORWBT-UHFFFAOYSA-N
[SMILES]

C1(CC(O)=O)=CC=CC=C1Br
[CAS DataBase Reference]

18698-97-0(CAS DataBase Reference)
[EPA Substance Registry System]

18698-97-0(EPA Substance)
Questions And AnswerBack Directory
[Preparation]

2-Bromophenylacetic acid can be produced by removing the sulfonic acid group through the bromination of p-sulfonophenylacetic acid and the hydrolysis of 2-bromo-4-sulfonophenylacetic acid.

Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[Risk Statements ]

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

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163990
[Storage Class]

11 - Combustible Solids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Bromophenylacetic acid(18698-97-0).msds
Hazard InformationBack Directory
[Chemical Properties]

almost white to light beige crystals or powder
[Uses]

Employed as a pharmaceutical intermediate. It is also used in organic synthesis.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 49, p. 4226, 1984 DOI: 10.1021/jo00196a024
Spectrum DetailBack Directory
[Spectrum Detail]

2-Bromophenylacetic acid(18698-97-0)MS
2-Bromophenylacetic acid(18698-97-0)1HNMR
2-Bromophenylacetic acid(18698-97-0)13CNMR
2-Bromophenylacetic acid(18698-97-0)IR1
2-Bromophenylacetic acid(18698-97-0)IR2
2-Bromophenylacetic acid(18698-97-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Bromophenylacetic acid, 98%(18698-97-0)
[Alfa Aesar]

2-Bromophenylacetic acid, 98+%(18698-97-0)
[Sigma Aldrich]

18698-97-0(sigmaaldrich)
[TCI AMERICA]

2-Bromophenylacetic Acid,>98.0%(GC)(T)(18698-97-0)
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