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Home> Encyclopedia > Hot Product Listed 2   > 2-Butanol, 2-methyl-,2-acetate
666817-90-9 structure

2-Butanol, 2-methyl-,2-acetate

Iupac Name:2-(3-benzoylphenyl)-N-(3-methylphenyl)propanamide
CAS No.:666817-90-9
Molecular Weight:343.426
Molecular Formula:C12H13CLN2O2 (isomer)
Names and Identifiers
Properties
Density
1.195
Flash Point
°C
Computational chemical data
  • Molecular Weight:343.426g/mol
  • Molecular Formula:C12H13CLN2O2
  • Compound Is Canonicalized:True
  • XLogP3-AA:4.8
  • Exact Mass:343.157
  • Monoisotopic Mass:343.157
  • Complexity:483
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:46.2A^2
  • Heavy Atom Count:26
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB6MAAAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAAABUAAAHgAQAAAADQyBmAAywILAAACI AqVSUACCAAAlAgAIiAEAZMgIIDLAlZGEIQhglADIyYcYiMCOgAACQAAAAAAAAASAAAAAAAAAAAAA AA==
 
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