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Home> Hot Product Listed 2   > 2(1H)-Quinolinone,7-ethoxy-4-methyl-
671188-82-2 structure

2(1H)-Quinolinone,7-ethoxy-4-methyl-

Iupac Name:3-(4-fluorophenyl)-3-oxopropanamide
CAS No.:671188-82-2
Molecular Weight:181.166
Molecular Formula:C8H9NO (isomer)
Names and Identifiers
Synonyms

7-ethoxy-4-methylquinolin-2(1h)-one AK432990 AKOS027394623 Carbostyril, 7-ethoxy-4-methyl- (6CI) Carbostyril,7-ethoxy-4-methyl- (6CI)

Inchi
InChI=1S/C9H8FNO2/c10-7-3-1-6(2-4-7)8(12)5-9(11)13/h1-4H,5H2,(H2,11,13)
InChkey
OCMBRGOMXXXXHT-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC=C1C(=O)CC(=O)N)F
Computational chemical data
  • Molecular Weight:181.166g/mol
  • Molecular Formula:C8H9NO
  • Compound Is Canonicalized:True
  • Exact Mass:181.054
  • Monoisotopic Mass:181.054
  • Complexity:210
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:60.2A^2
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccByMQAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHwAQAAAADASBmAgwAIBAAACI AqFSEAACAAAkAAAIiAEAAMgIIDqIlRCAIQAgkAAIiYcYiICOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
 
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