Name: Name:1H-1,2,4-Triazole, 3,5-diethyl-
Brand: Angene
SKU: AG005ZIA
Rating: 90 (10 reviews)

1H-1,2,4-Triazole, 3,5-diethyl-

CAS No.:

7343-35-3

Catalog Number:

AG005ZIA

Molecular Formula:

C6H11N3

Molecular Weight:

125.1716

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Product Description

Catalog Number:

AG005ZIA

Chemical Name:

1H-1,2,4-Triazole, 3,5-diethyl-

CAS Number:

7343-35-3

Molecular Formula:

C6H11N3

Molecular Weight:

125.1716

MDL Number:

MFCD14620080

IUPAC Name:

3,5-diethyl-1H-1,2,4-triazole

InChI:

InChI=1S/C6H11N3/c1-3-5-7-6(4-2)9-8-5/h3-4H2,1-2H3,(H,7,8,9)

InChI Key:

UGERGYDWQOPISO-UHFFFAOYSA-N

SMILES:

CCc1[nH]nc(n1)CC

Properties

Complexity:

84.4

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

125.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

125.175g/mol

Monoisotopic Mass:

125.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
Optimized acetylene/carbon dioxide sorption in a dynamic porous crystal.	Journal of the American Chemical Society 20090422
Exceptional framework flexibility and sorption behavior of a multifunctional porous cuprous triazolate framework.	Journal of the American Chemical Society 20080507
Copper(I) 1,2,4-triazolates and related complexes: studies of the solvothermal ligand reactions, network topologies, and photoluminescence properties.	Journal of the American Chemical Society 20050420