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90111-58-3

90111-58-3 Structure

90111-58-3 Structure
IdentificationBack Directory
[Name]

4-CARBOXYMETHYL-PHENYLBORONIC ACID
[CAS]

90111-58-3
[Synonyms]

4-Boronophenylacetic acid
4-boronoBenzeneacetic acid
Benzeneacetic acid, 4-borono-
2-(4-Boronophenyl)acetic acid
4-Acetic acid-benzeneboronic acid
4-CARBOXYMETHYL-PHENYLBORONIC ACID
4-(Carboxymethyl)benzeneboronic acid
[4-(DIHYDROXYBORYL)PHENYL]ACETIC ACID
2-[4-(dihydroxyboranyl)phenyl]acetic acid
4-Boronophenylacetic acid, (4-Boronophenyl)acetic acid
4-(Carboxymethyl)phenylboronic Acid (contains varying amounts of Anhydride)
[Molecular Formula]

C8H9BO4
[MDL Number]

MFCD03425919
[MOL File]

90111-58-3.mol
[Molecular Weight]

179.97
Chemical PropertiesBack Directory
[Melting point ]

158-160°C
[Boiling point ]

416.1±47.0 °C(Predicted)
[density ]

1.33±0.1 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.23±0.10(Predicted)
[color ]

White to Off-White
[InChI]

1S/C8H9BO4/c10-8(11)5-6-1-3-7(4-2-6)9(12)13/h1-4,12-13H,5H2,(H,10,11)
[InChIKey]

NFGJQVPDPIGBJE-UHFFFAOYSA-N
[SMILES]

OB(O)C1=CC=C(CC(O)=O)C=C1
Safety DataBack Directory
[Risk Statements ]

36
[Safety Statements ]

26
[WGK Germany ]

WGK 3
[HS Code ]

2931900090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Hazard InformationBack Directory
[Uses]

4-Carboxymethylphenylboronic acid
Spectrum DetailBack Directory
[Spectrum Detail]

4-CARBOXYMETHYL-PHENYLBORONIC ACID(90111-58-3)1HNMR
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