Name: Name:1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 4-chloro-, ethyl ester
Brand: Angene
SKU: AG000KMS
Rating: 90 (10 reviews)

1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 4-chloro-, ethyl ester

CAS No.:

1234616-12-6

Catalog Number:

AG000KMS

Molecular Formula:

C10H9ClN2O2

Molecular Weight:

224.6437

Catalog Number:

AG000KMS

Chemical Name:

1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 4-chloro-, ethyl ester

CAS Number:

1234616-12-6

Molecular Formula:

C10H9ClN2O2

Molecular Weight:

224.6437

IUPAC Name:

ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-3-carboxylate

InChI:

InChI=1S/C10H9ClN2O2/c1-2-15-10(14)6-3-13-8-5-12-4-7(11)9(6)8/h3-5,13H,2H2,1H3

InChI Key:

BDJGZEWHTDMFSL-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c[nH]c2c1c(Cl)cnc2

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.644g/mol

Monoisotopic Mass:

224.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8