Name: Name:2-(2-chloroethyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one
Brand: Angene
SKU: AG019XWS
Rating: 90 (10 reviews)

2-(2-chloroethyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one

CAS No.:

137540-94-4

Catalog Number:

AG019XWS

Molecular Formula:

C8H8ClN3O

Molecular Weight:

197.6216

Catalog Number:

AG019XWS

Chemical Name:

2-(2-chloroethyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one

CAS Number:

137540-94-4

Molecular Formula:

C8H8ClN3O

Molecular Weight:

197.6216

MDL Number:

MFCD08282228

IUPAC Name:

2-(2-chloroethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-one

InChI:

InChI=1S/C8H8ClN3O/c9-4-6-12-8(13)11-5-2-1-3-7(11)10-12/h1-3,5H,4,6H2

InChI Key:

TYQKZFOAABYLAF-UHFFFAOYSA-N

SMILES:

ClCCn1nc2n(c1=O)cccc2

Complexity:

321

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.622g/mol

Monoisotopic Mass:

197.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8