4-Thiazoleboronic Acid - CAS 1016642-07-1

Catalog:	BB000587
Product Name:	4-Thiazoleboronic Acid
CAS:	1016642-07-1
Synonyms:	4-thiazolylboronic acid; 1,3-thiazol-4-ylboronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1,3-thiazol-4-ylboronic acid
Description:	4-Thiazoleboronic Acid (CAS# 1016642-07-1) is a useful research chemical.
Molecular Weight:	128.95
Molecular Formula:	C3H4NO2SB
Canonical SMILES:	B(C1=CSC=N1)(O)O
InChI:	InChI=1S/C3H4BNO2S/c6-4(7)3-1-8-2-5-3/h1-2,6-7H
InChI Key:	WSTDOIHBEOVTHX-UHFFFAOYSA-N
Storage:	Inert atmosphere, Store in freezer, under -20 °C
MDL:	MFCD09879002
LogP:	-1.17710

Publication Number	Title	Priority Date
CN-111440162-A	Thiazole dihydronaphthalene derivative and application thereof in metabolic diseases	20200401
US-2021078994-A1	MTA-Cooperative PRMT5 Inhibitors	20190912
US-2021079003-A1	MTA-Cooperative PRMT5 Inhibitors	20190912
WO-2021050915-A1	Mta-cooperative prmt5 inhibitors	20190912
CN-113271946-A	Functionalized heterocyclic compounds as antiviral agents	20181121

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Related Functional Groups

Boronic Acids and Esters

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2-(Methoxycarbonyl)-4-methylphenylboronic Acid
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[10365-98-7]
3-Methoxybenzeneboronic Acid
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Potassium (4-Cyanophenyl)trifluoroborate
[1029439-85-7]
2,3-Difluoro-4-hydroxyphenylboronic Acid Pinacol Ester
[2247367-07-1]
4,4,4',4',5,5,5',5'-octaethyl-2,2'-bi(1,3,2-dioxaborolane)

GHS Hazard Statement:	H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	81.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	129.0055797
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	129.0055797
Rotatable Bond Count:	1
Topological Polar Surface Area:	81.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0