ChemicalBook--->CAS DataBase List--->852362-24-4

852362-24-4

852362-24-4 Structure

852362-24-4 Structure
IdentificationBack Directory
[Name]

PYRIMIDIN-4-YLBORONIC ACID
[CAS]

852362-24-4
[Synonyms]

4-Boronopyrimidine
PyriMidin-4-boronic acid
Pyrimidine-4-boronic acid
Pyrimidine-3-boronic acid
PYRIMIDIN-4-YLBORONIC ACID
Boronic acid,B-4-pyriMidinyl-
Pyrimidin-4-ylboronic Acid (~80%)
[Molecular Formula]

C4H5BN2O2
[MDL Number]

MFCD08234611
[MOL File]

852362-24-4.mol
[Molecular Weight]

123.91
Chemical PropertiesBack Directory
[Melting point ]

>205°C (dec.)
[Boiling point ]

334.7±34.0 °C(Predicted)
[density ]

1.33
[storage temp. ]

Refrigerator, under inert atmosphere
[solubility ]

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

Solid
[pka]

6.86±0.53(Predicted)
[color ]

White to Off-White
[InChI]

InChI=1S/C4H5BN2O2/c8-5(9)4-1-2-6-3-7-4/h1-3,8-9H
[InChIKey]

YQEFFTJDRKXKAP-UHFFFAOYSA-N
[SMILES]

B(C1C=CN=CN=1)(O)O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H317-H319
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

Pyrimidin-4-ylboronic Acid is an intermediate used to prepare aldosterone synthase inhibiting pyrimidinylnaphthalenes via Suzuki cross-coupling reactions. It is also used in the synthesis of [7-(2,6-dichlorophenyl)-5-methylbenzo [1,2,4]triazin-3-yl]-[4-(2-pyrrolidin-1-ylethoxy)phenyl]amine as a potent, orally active Src kinase inhibitor with antitumor activity.
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