Name: Name:Ethyl 4-chloro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Brand: Angene
SKU: AG00DHWF
Rating: 90 (10 reviews)

Ethyl 4-chloro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

CAS No.:

50476-72-7

Catalog Number:

AG00DHWF

Molecular Formula:

C9H8ClN3O2

Molecular Weight:

225.6317

Catalog Number:

AG00DHWF

Chemical Name:

Ethyl 4-chloro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

CAS Number:

50476-72-7

Molecular Formula:

C9H8ClN3O2

Molecular Weight:

225.6317

MDL Number:

MFCD13195404

IUPAC Name:

ethyl 4-chloro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

InChI:

InChI=1S/C9H8ClN3O2/c1-2-15-9(14)6-3-11-8-5(7(6)10)4-12-13-8/h3-4H,2H2,1H3,(H,11,12,13)

InChI Key:

PJMVISKPSDWZFO-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnc2c(c1Cl)cn[nH]2

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.632g/mol

Monoisotopic Mass:

225.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7