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913835-75-3

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913835-75-3 Structure

913835-75-3 Structure
IdentificationBack Directory
[Name]

5-CARBOXY-2-CHLOROBENZENEBORONIC ACID 98
[CAS]

913835-75-3
[Synonyms]

5-Carboxy-2-chL
3-BORONO-4-CHLOROBENZOIC ACID
5-Carboxy-2-Chlorophenylboroni
Benzoic acid, 3-borono-4-chloro-
5-CARBOXY-2-CHLOROPHENYLBORONIC ACID
2-CHLORO-5-CARBOXYPHENYLBORONIC ACID
5-CARBOXY-2-CHLOROBENZENEBORONIC ACID
5-CARBOXY-2-CHLOROBENZENEBORONIC ACID 98
5-Carboxy-2-chlorobenzeneboronic acid 98%
4-chloro-3-(dihydroxyboranyl)benzoic acid
REF DUPL: 5-Carboxy-2-chlorophenylboronic acid
5-Carboxy-2-chlorophenylboronic Acid (contains varying amounts of Anhydride)
5-CARBOXY-2-CHLOROBENZENEBORONIC ACID; (5-CARBOXY-2-CHLOROPHENYL)BORONIC ACID
[Molecular Formula]

C7H6BClO4
[MDL Number]

MFCD08689491
[MOL File]

913835-75-3.mol
[Molecular Weight]

200.384
Chemical PropertiesBack Directory
[Melting point ]

228-244
[Boiling point ]

462.5±55.0 °C(Predicted)
[density ]

1.55±0.1 g/cm3(Predicted)
[storage temp. ]

Keep Cold
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

3.98±0.10(Predicted)
[color ]

White to Almost white
[InChI]

1S/C7H6BClO4/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,12-13H,(H,10,11)
[InChIKey]

ZITWKFSVFMUWIE-UHFFFAOYSA-N
[SMILES]

OB(C1=CC(C(O)=O)=CC=C1Cl)O
[CAS DataBase Reference]

913835-75-3
Hazard InformationBack Directory
[Uses]

suzuki reaction
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

41
[Safety Statements ]

26-39
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant/Keep Cold
[HazardClass ]

IRRITANT, KEEP COLD
[HS Code ]

2931900090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Spectrum DetailBack Directory
[Spectrum Detail]

5-CARBOXY-2-CHLOROBENZENEBORONIC ACID 98(913835-75-3)1HNMR
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