ChemicalBook--->CAS DataBase List--->13631-21-5

13631-21-5

13631-21-5 Structure

13631-21-5 Structure
IdentificationMore
[Name]

4-BROMO-3-CHLOROPHENOL
[CAS]

13631-21-5
[Synonyms]

4-BROMO-3-CHLOROPHENOL
[Molecular Formula]

C6H4BrClO
[MDL Number]

MFCD00070744
[Molecular Weight]

207.45
[MOL File]

13631-21-5.mol
Chemical PropertiesBack Directory
[Melting point ]

64-66°C
[Boiling point ]

267.5±20.0 °C(Predicted)
[density ]

1.788±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

8.43±0.18(Predicted)
[color ]

White to Almost white
[Water Solubility ]

Slightly soluble in water.
[BRN ]

3236445
[InChI]

InChI=1S/C6H4BrClO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H
[InChIKey]

FQEYHIPPYOSPLF-UHFFFAOYSA-N
[SMILES]

C1(O)=CC=C(Br)C(Cl)=C1
[CAS DataBase Reference]

13631-21-5(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H312-H315-H319-H335
[Precautionary statements ]

P280h-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

WGK 3
[HS Code ]

2908.19.6000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

4-Bromo-3-chlorophenol is used as a precursor in organic synthesis to prepare 4-(benzyloxy)-l-bromo-2-chlorobenzene by reaction with benzyl bromide.
[Synthesis]

45.7 g (0.466 mol) of 3-chlorophenol and 80 mL of carbon tetrachloride were added into a four-necked flask, and 82.74 g (0.465 mol) of NBS was added in batches under stirring, and the reaction was carried out at a certain temperature temperature, and
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMO-3-CHLOROPHENOL(13631-21-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

4-Bromo-3-chlorophenol, 98%(13631-21-5)
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