Name: Name:4-AMINO-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-5-METHYL-4H-1,2,4-TRIAZOL-1-IUM +
Brand: Angene
SKU: AG01AQ0R
Rating: 90 (10 reviews)

4-AMINO-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-5-METHYL-4H-1,2,4-TRIAZOL-1-IUM +

CAS No.:

880-92-2

Catalog Number:

AG01AQ0R

Molecular Formula:

C8H13ClN6

Molecular Weight:

228.6820

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Purity

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Product Description

Catalog Number:

AG01AQ0R

Chemical Name:

4-AMINO-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-5-METHYL-4H-1,2,4-TRIAZOL-1-IUM +

CAS Number:

880-92-2

Molecular Formula:

C8H13ClN6

Molecular Weight:

228.6820

MDL Number:

MFCD00718927

IUPAC Name:

3-(3,5-dimethylpyrazol-1-yl)-5-methyl-1,2,4-triazol-4-amine;hydrochloride

InChI:

InChI=1S/C8H12N6.ClH/c1-5-4-6(2)14(12-5)8-11-10-7(3)13(8)9;/h4H,9H2,1-3H3;1H

InChI Key:

LZLWBNYIVSDOQK-UHFFFAOYSA-N

SMILES:

Cc1cc(n(n1)c1nnc(n1N)C)C.Cl

Properties

Complexity:

210

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.684g/mol

Monoisotopic Mass:

228.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501