Name: Name:1,2,4-Triazolo[4,3-b]pyridazine-8-carboxylic acid, 6-chloro-3-methyl-
Brand: Angene
SKU: AG001GON
Rating: 90 (10 reviews)

1,2,4-Triazolo[4,3-b]pyridazine-8-carboxylic acid, 6-chloro-3-methyl-

CAS No.:

1416222-83-7

Catalog Number:

AG001GON

Molecular Formula:

C7H5ClN4O2

Molecular Weight:

212.5932

Catalog Number:

AG001GON

Chemical Name:

1,2,4-Triazolo[4,3-b]pyridazine-8-carboxylic acid, 6-chloro-3-methyl-

CAS Number:

1416222-83-7

Molecular Formula:

C7H5ClN4O2

Molecular Weight:

212.5932

IUPAC Name:

6-chloro-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylic acid

InChI:

InChI=1S/C7H5ClN4O2/c1-3-9-10-6-4(7(13)14)2-5(8)11-12(3)6/h2H,1H3,(H,13,14)

InChI Key:

TXOJKPQFQTWZOA-UHFFFAOYSA-N

SMILES:

Clc1cc(C(=O)O)c2n(n1)c(C)nn2

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.593g/mol

Monoisotopic Mass:

212.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6