3-(Chloromethyl)-4,5-dimethyl-4H-1,2,4-triazole - CAS 881845-16-5

Catalog:	BB038773
Product Name:	3-(Chloromethyl)-4,5-dimethyl-4H-1,2,4-triazole
CAS:	881845-16-5
Synonyms:	3-(chloromethyl)-4,5-dimethyl-1,2,4-triazole; 3-(chloromethyl)-4,5-dimethyl-1,2,4-triazole

Technical Data

Patents

Computed Properties

IUPAC Name:	3-(chloromethyl)-4,5-dimethyl-1,2,4-triazole
Description:	3-(Chloromethyl)-4,5-dimethyl-4H-1,2,4-triazole (CAS# 881845-16-5 ) is a useful research chemical.
Molecular Weight:	145.59
Molecular Formula:	C5H8ClN3
Canonical SMILES:	CC1=NN=C(N1C)CCl
InChI:	InChI=1S/C5H8ClN3/c1-4-7-8-5(3-6)9(4)2/h3H2,1-2H3
InChI Key:	LSWIXGUFXFSQHS-UHFFFAOYSA-N
LogP:	0.86230

Publication Number	Title	Priority Date
WO-2020249785-A1	Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators	20190614
US-2021017169-A1	Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators	20190614
US-2020308145-A1	Benzimidazole derivatives and their uses	20171019
JP-2017526726-A	Heterocyclic compounds and uses thereof	20140915
EP-2970265-B1	Heterocyclic compounds and uses thereof	20130315

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

Triazole/Tetrazole

[1005651-99-9]
5-[(5-Methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
[828291-81-2]
5-(3-((2-Bromophenoxy)methyl)phenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
[1005680-56-7]
Ethyl ({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-YL]-4H-1,2,4-triazol-3-YL}thio)acetate
[13616-37-0]
Ethyl 1H-tetrazole-5-acetate
[1823462-45-8]
Ethyl 2-(3-chloro-1H-1,2,4-triazol-1-yl)butanoate
[1823967-22-1]
Ethyl 2-(3-chloro-1H-1,2,4-triazol-1-yl)propanoate

Complexity:	98.2
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	145.040675
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	145.040675
Rotatable Bond Count:	1
Topological Polar Surface Area:	30.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3