Name: Name:3-Quinolinecarbonitrile, 4-hydroxy-6-methoxy-
Brand: Angene
SKU: AG001280
Rating: 90 (10 reviews)

3-Quinolinecarbonitrile, 4-hydroxy-6-methoxy-

CAS No.:

13669-61-9

Catalog Number:

AG001280

Molecular Formula:

C11H8N2O2

Molecular Weight:

200.1934

Catalog Number:

AG001280

Chemical Name:

3-Quinolinecarbonitrile, 4-hydroxy-6-methoxy-

CAS Number:

13669-61-9

Molecular Formula:

C11H8N2O2

Molecular Weight:

200.1934

MDL Number:

MFCD09743998

IUPAC Name:

6-methoxy-4-oxo-1H-quinoline-3-carbonitrile

InChI:

InChI=1S/C11H8N2O2/c1-15-8-2-3-10-9(4-8)11(14)7(5-12)6-13-10/h2-4,6H,1H3,(H,13,14)

InChI Key:

OTDUOKQHVNMOLT-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)c(O)c(cn2)C#N

NSC Number:

366401

Complexity:

353

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

200.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

200.197g/mol

Monoisotopic Mass:

200.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5