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221006-67-3

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221006-67-3 Structure

221006-67-3 Structure
IdentificationBack Directory
[Name]

4-BROMO-3-METHYLPHENYLBORONIC ACID
[CAS]

221006-67-3
[Synonyms]

4-BROMO-3-METHYLPHENYLBORONIC ACID
Boronic acid, B-(4-bromo-3-methylphenyl)-
[Molecular Formula]

C7H8BBrO2
[MDL Number]

MFCD17011983
[MOL File]

221006-67-3.mol
[Molecular Weight]

214.85
Chemical PropertiesBack Directory
[Melting point ]

>250 °C(Solv: acetonitrile (75-05-8))
[Boiling point ]

336.1±52.0 °C(Predicted)
[density ]

1.57±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

8.36±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C7H8BBrO2/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4,10-11H,1H3
[InChIKey]

WATLRNVCMDWRNM-UHFFFAOYSA-N
[SMILES]

B(C1=CC=C(Br)C(C)=C1)(O)O
Safety DataBack Directory
[HS Code ]

2931900090
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMO-3-METHYLPHENYLBORONIC ACID(221006-67-3)1HNMR
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