1-(3-Oxetanyl)-1H-pyrazole-4-boronic Acid Pinacol Ester - CAS 1339890-99-1

Name: 1-(3-Oxetanyl)-1H-pyrazole-4-boronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB007848
Product Name:	1-(3-Oxetanyl)-1H-pyrazole-4-boronic Acid Pinacol Ester
CAS:	1339890-99-1
Synonyms:	1-(3-oxetanyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole; 1-(oxetan-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole

Technical Data

IUPAC Name:	1-(oxetan-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
Description:	1-(3-Oxetanyl)-1H-pyrazole-4-boronic Acid Pinacol Ester (CAS# 1339890-99-1 ) is a useful research chemical.
Molecular Weight:	250.10
Molecular Formula:	C12H19N2O3B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C3COC3
InChI:	InChI=1S/C12H19BN2O3/c1-11(2)12(3,4)18-13(17-11)9-5-14-15(6-9)10-7-16-8-10/h5-6,10H,7-8H2,1-4H3
InChI Key:	KIYMAKQVFHPNGB-UHFFFAOYSA-N
MDL:	MFCD21337762
LogP:	0.75360

Publication Number	Title	Priority Date
US-2021214366-A1	Bicyclic heterocycles as fgfr inhibitors	20200115
WO-2021129621-A1	Pyrazole compounds	20191223
US-2021171535-A1	Tricyclic heterocycles as fgfr inhibitors	20191204
WO-2021113479-A1	Tricyclic heterocycles as fgfr inhibitors	20191204
WO-2021068755-A1	Compound having brd4 inhibitory activity, preparation method therefor and use thereof	20191008

Complexity:	317
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	250.1488726
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	250.1488726
Rotatable Bond Count:	2
Topological Polar Surface Area:	45.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0