Name: Name:ethyl 7a-hydroxy-2-oxo-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[b]pyridine-4a-carboxylate
Brand: Angene
SKU: AG01ACF2
Rating: 90 (10 reviews)

ethyl 7a-hydroxy-2-oxo-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[b]pyridine-4a-carboxylate

CAS No.:

1803598-67-5

Catalog Number:

AG01ACF2

Molecular Formula:

C11H15NO4

Molecular Weight:

225.2411

Catalog Number:

AG01ACF2

Chemical Name:

ethyl 7a-hydroxy-2-oxo-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[b]pyridine-4a-carboxylate

CAS Number:

1803598-67-5

Molecular Formula:

C11H15NO4

Molecular Weight:

225.2411

MDL Number:

MFCD26936021

IUPAC Name:

ethyl 7a-hydroxy-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-4a-carboxylate

InChI:

InChI=1S/C11H15NO4/c1-2-16-9(14)10-5-3-6-11(10,15)12-8(13)4-7-10/h4,7,15H,2-3,5-6H2,1H3,(H,12,13)

InChI Key:

PSDAQYXKOOMFSQ-UHFFFAOYSA-N

SMILES:

CCOC(=O)C12CCCC2(O)NC(=O)C=C1

Complexity:

365

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.244g/mol

Monoisotopic Mass:

225.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6