ChemicalBook--->CAS DataBase List--->845551-44-2

845551-44-2

845551-44-2 Structure

845551-44-2 Structure
IdentificationMore
[Name]

4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
[CAS]

845551-44-2
[Synonyms]

(3-CHLORO-4-BENZYLOXYPHENYL)BORONIC ACID
4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
AKOS BRN-0594
4-Benzyloxy-3-chlorophenylboro
[Molecular Formula]

C13H12BClO3
[MDL Number]

MFCD04115642
[Molecular Weight]

262.5
[MOL File]

845551-44-2.mol
Chemical PropertiesBack Directory
[Melting point ]

188-193 °C (lit.)
[Boiling point ]

450.2±55.0 °C(Predicted)
[density ]

1.30±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

7.67±0.17(Predicted)
[color ]

White to Almost white
[InChI]

1S/C13H12BClO3/c15-12-8-11(14(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
[InChIKey]

AYSMMNDQVZAXQY-UHFFFAOYSA-N
[SMILES]

OB(O)c1ccc(OCc2ccccc2)c(Cl)c1
[CAS DataBase Reference]

845551-44-2(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[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 ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29310095
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

suzuki reaction
Spectrum DetailBack Directory
[Spectrum Detail]

4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID(845551-44-2)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

845551-44-2(sigmaaldrich)
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