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1201657-32-0

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1201657-32-0 Structure

1201657-32-0 Structure
IdentificationBack Directory
[Name]

2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate
[CAS]

1201657-32-0
[Synonyms]

ethyl 2-Methyl-2-(4-(4
2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate
ethyl 2-Methyl-2-(4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate
1H-Pyrazole-1-acetic acid, α,α-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester
[Molecular Formula]

C15H25BN2O4
[MDL Number]

MFCD18383253
[MOL File]

1201657-32-0.mol
[Molecular Weight]

308.18
Chemical PropertiesBack Directory
[Boiling point ]

406.2±25.0 °C(Predicted)
[density ]

1.08±0.1 g/cm3(Predicted)
[pka]

1.53±0.10(Predicted)
[InChI]

InChI=1S/C15H25BN2O4/c1-8-20-12(19)13(2,3)18-10-11(9-17-18)16-21-14(4,5)15(6,7)22-16/h9-10H,8H2,1-7H3
[InChIKey]

FIXNVGDENQNXPD-UHFFFAOYSA-N
[SMILES]

C(OCC)(=O)C(C)(N1C=C(B2OC(C)(C)C(C)(C)O2)C=N1)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

Ethyl 2-Methyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate is used as a reactant in the preparation of inhibitors that overcome the G1202R anaplastic lymphoma kinase resistance mutation.
Spectrum DetailBack Directory
[Spectrum Detail]

2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate(1201657-32-0)1HNMR
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