3-(4-Bromophenyl)-1,2,4-oxadiazol-5(4H)-one - CAS 16672-19-8

Catalog:	BB012306
Product Name:	3-(4-Bromophenyl)-1,2,4-oxadiazol-5(4H)-one
CAS:	16672-19-8
Synonyms:	3-(4-bromophenyl)-4H-1,2,4-oxadiazol-5-one; 3-(4-bromophenyl)-4H-1,2,4-oxadiazol-5-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(4-bromophenyl)-4H-1,2,4-oxadiazol-5-one
Description:	3-(4-Bromophenyl)-1,2,4-oxadiazol-5(4H)-one (CAS# 16672-19-8) is a useful research chemical.
Molecular Weight:	241.04
Molecular Formula:	C8H5BrN2O2
Canonical SMILES:	C1=CC(=CC=C1C2=NOC(=O)N2)Br
InChI:	InChI=1S/C8H5BrN2O2/c9-6-3-1-5(2-4-6)7-10-8(12)13-11-7/h1-4H,(H,10,11,12)
InChI Key:	INJVJPDDSBYUMW-UHFFFAOYSA-N
Boiling Point:	286.671 °C at 760 mmHg
Density:	1.853 g/cm³
LogP:	1.79240

Publication Number	Title	Priority Date
AU-2018268311-A1	Pyrimidine derivatives as PGE2 receptor modulators	20170518
AU-2018269666-A1	Phenyl derivatives as PGE2 receptor modulators	20170518
BR-112019024109-A2	COMPOUND, PHARMACEUTICAL COMPOSITION, USE OF A PHARMACEUTICALLY ACCEPTABLE COMPOUND OR SALT, METHOD OF MODULATING AN IMMUNE RESPONSE IN AN INDIVIDUAL WITH A TUMOR, AND, PROPHYLAXY OR TREATMENT METHOD	20170518
EP-3625222-A1	Phenyl derivatives as pge2 receptor modulators	20170518
EP-3625227-A1	Benzofurane and benzothiophene derivatives as pge2 receptor modulators	20170518

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Oxazole/Thiazole

[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[1401934-53-9]
2-Amino-4-(3,4-dimethoxyphenyl)-5-phenylthiazole
[262857-90-9]
(R)-4-(4-Aminobenzyl)-2-oxazolidinone
[937598-26-0]
Ethyl 2-(butylamino)-4-(chloromethyl)-1,3-thiazole-5-carboxylate
[886497-64-9]
Ethyl 2-(butylamino)-4-methylthiazole-5-carboxylate
[938001-01-5]
Ethyl 2-(m-tolylamino)-4-(trifluoromethyl)thiazole-5-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	247
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.95344
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	239.95344
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1