ChemicalBook--->CAS DataBase List--->948592-80-1

948592-80-1

948592-80-1 Structure

948592-80-1 Structure
IdentificationBack Directory
[Name]

2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER
[CAS]

948592-80-1
[Synonyms]

2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER
2-Amino-5-methylbenzeneboronic acid, pinacol ester
4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-4-methylphenylamine
4-Methyl-2-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-phenylaMine
Benzenamine, 4-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
3-hydroxy-2,3-dimethylbutan-2-yl hydrogen (2-amino-5-methylphenyl)boronate
[Molecular Formula]

C13H20BNO2
[MDL Number]

MFCD06795664
[MOL File]

948592-80-1.mol
[Molecular Weight]

233.11
Chemical PropertiesBack Directory
[Melting point ]

82-85°C
[Boiling point ]

355.7±35.0 °C(Predicted)
[density ]

1.03±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[solubility ]

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

Solid
[pka]

4.33±0.10(Predicted)
[color ]

White to Off-White
[InChI]

1S/C13H20BNO2/c1-9-6-7-11(15)10(8-9)14-16-12(2,3)13(4,5)17-14/h6-8H,15H2,1-5H3
[InChIKey]

LOOBNTHIWCHTCR-UHFFFAOYSA-N
[SMILES]

B2(OC(C(O2)(C)C)(C)C)c1c(ccc(c1)C)N
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[HS Code ]

2931900090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

2-Amino-5-methylphenyboronic acid, pinacol ester
Spectrum DetailBack Directory
[Spectrum Detail]

2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER(948592-80-1)1HNMR
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