2,4-Dimethylthiazole-5-boronic Acid Pinacol Ester - CAS 859833-13-9

Name: 2,4-Dimethylthiazole-5-boronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB037791
Product Name:	2,4-Dimethylthiazole-5-boronic Acid Pinacol Ester
CAS:	859833-13-9
Synonyms:	2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiazole; 2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole

Technical Data

IUPAC Name:	2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
Description:	2,4-Dimethylthiazole-5-boronic Acid Pinacol Ester (CAS# 859833-13-9) is a useful research chemical.
Molecular Weight:	239.14
Molecular Formula:	C11H18NO2SB
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=C(N=C(S2)C)C
InChI:	InChI=1S/C11H18BNO2S/c1-7-9(16-8(2)13-7)12-14-10(3,4)11(5,6)15-12/h1-6H3
InChI Key:	AZYDPQHPHNHZPL-UHFFFAOYSA-N
Boiling Point:	331.3 °C at 760 mmHg
Density:	1.08 g/cm³
Appearance:	Solid
MDL:	MFCD07783649
LogP:	2.05910

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021113263-A1	Crf receptor antagonists and methods of use	20191204
US-2021276996-A1	Degraders that target proteins via keap1	20180720
TW-201938156-A	Dihydroporphyrinone derivatives	20180118
CN-111630052-A	Dihydroindazinone derivatives	20180118
EP-3741757-A1	Dihydroindolizinone derivative	20180118

Complexity:	269
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.1151302
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	239.1151302
Rotatable Bond Count:	1
Topological Polar Surface Area:	59.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0