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797755-07-8

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797755-07-8 Structure

797755-07-8 Structure
IdentificationBack Directory
[Name]

Phenylacetic acid-4-boronic acid pinacol ester
[CAS]

797755-07-8
[Synonyms]

4-(Carboxymethyl)phenylboronic acidpinacol ester
4-(Carboxymethyl)phenylboronic acid pinacol ester 95%
[4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]acetic acid
2-[4-(Carboxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Benzeneacetic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetic acid
[Molecular Formula]

C14H19BO4
[MDL Number]

MFCD04038755
[MOL File]

797755-07-8.mol
[Molecular Weight]

262.12
Chemical PropertiesBack Directory
[Melting point ]

165-170°C
[Boiling point ]

398.2±25.0 °C(Predicted)
[density ]

1.13±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

Crystalline Powder or Powder
[pka]

4.24±0.10(Predicted)
[color ]

White to yellow
[InChI]

1S/C14H19BO4/c1-13(2)14(3,4)19-15(18-13)11-7-5-10(6-8-11)9-12(16)17/h5-8H,9H2,1-4H3,(H,16,17)
[InChIKey]

FNLWHBHWDXCWHV-UHFFFAOYSA-N
[SMILES]

CC1(C)OB(OC1(C)C)c2ccc(CC(O)=O)cc2
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39
[WGK Germany ]

1
[HazardClass ]

IRRITANT
[HS Code ]

2931900090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

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

4-(Carboxymethyl)phenylboronic acid pinacol ester
Spectrum DetailBack Directory
[Spectrum Detail]

Phenylacetic acid-4-boronic acid pinacol ester(797755-07-8)1HNMR
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