Name: Name:5-Chloro-6-iodo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid
Brand: Angene
SKU: AG00HHQ3
Rating: 90 (10 reviews)

5-Chloro-6-iodo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid

CAS No.:

1246088-58-3

Catalog Number:

AG00HHQ3

Molecular Formula:

C8H4ClIN2O2

Molecular Weight:

322.4870

Catalog Number:

AG00HHQ3

Chemical Name:

5-Chloro-6-iodo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid

CAS Number:

1246088-58-3

Molecular Formula:

C8H4ClIN2O2

Molecular Weight:

322.4870

IUPAC Name:

5-chloro-6-iodo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid

InChI:

InChI=1S/C8H4ClIN2O2/c9-5-4(8(13)14)3-1-2-11-7(3)12-6(5)10/h1-2H,(H,11,12)(H,13,14)

InChI Key:

SBHVWSMYWJTPSU-UHFFFAOYSA-N

SMILES:

OC(=O)c1c(Cl)c(I)nc2c1cc[nH]2

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

321.901g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

322.486g/mol

Monoisotopic Mass:

321.901g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2