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845885-86-1

845885-86-1 Structure

845885-86-1 Structure
IdentificationMore
[Name]

2-(4-PYRIDIL)-5,5-DIMETHYL-1,3,2-DIOXABORONANE
[CAS]

845885-86-1
[Synonyms]

2-(3-PYRIDIL)-5,5-DIMETHYL-1,3,2-DIOXABORONANE
2-(3-PYRIDYL)-5,5-DIMETHYL-1,2,3-DIOXABORANE
2-(3-PYRIDYL)-5,5-DIMETHYL-1,3,2-DIOXABORINANE
2-(4-PYRIDIL)-5,5-DIMETHYL-1,3,2-DIOXABORONANE
2-(4-PYRIDYL)-5,5-DIMETHYL-1,2,3-DIOXABORINANE
3-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)PYRIDINE
4-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)PYRIDINE
AKOS BRN-0243
AKOS BRN-0251
PYRIDINE-3-BORONIC ACID, NEOPENTYL ESTER
PYRIDINE-3-BORONIC ACID NEOPENTYLGLYCOL ESTER
5,5-Dimethyl-2-(pyridin-3-yl)-1,3,2-dioxaborinane
3-PYRIDINEBORONIC ACID NEOPENTYLGLYCOL ESTER, 97%
5,5-dimethyl-2-(3-pyridyl)-1,3,2-dioxaborinane
3-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)
5,5-Dimethyl-2-(3-pyridyl)-1,3,2-dioxaborinane, Pyridine-3-boronic acid neopentylglycol ester
[Molecular Formula]

C10H14BNO2
[MDL Number]

MFCD04039039
[Molecular Weight]

191.03
[MOL File]

845885-86-1.mol
Chemical PropertiesBack Directory
[Melting point ]

92-96 °C (lit.)
[Boiling point ]

309.8±15.0 °C(Predicted)
[density ]

1.05±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

solid
[pka]

5.22±0.12(Predicted)
[color ]

white
[InChI]

1S/C10H14BNO2/c1-10(2)7-13-11(14-8-10)9-4-3-5-12-6-9/h3-6H,7-8H2,1-2H3
[InChIKey]

QMEKTOQBDDVVBE-UHFFFAOYSA-N
[SMILES]

CC1(C)COB(OC1)c2cccnc2
[CAS DataBase Reference]

845885-86-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[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:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

2933399990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

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

3-Pyridineboronic acid neopentylglycol ester can be used as a reactant:
  • To synthesize N-alkyl-3-boronopyridinium salts by reacting with corresponding alkyl halides.
  • In the ruthenium-catalyzed diastereoselective C-H bond α-arylation of cyclic amines.
  • To prepare 2-(3-pyridyl)benzoxazole by reacting with benzoxazole via copper-catalyzed oxidative arylation reaction.
  • In the Suzuki-Miyaura cross-coupling reaction.

Spectrum DetailBack Directory
[Spectrum Detail]

2-(4-PYRIDIL)-5,5-DIMETHYL-1,3,2-DIOXABORONANE(845885-86-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)pyridine(845885-86-1)
[Sigma Aldrich]

845885-86-1(sigmaaldrich)
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