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Home> Hot Product Listed T   > T6577596
823-86-9 structure

T6577596

Iupac Name:N-(4-chlorophenyl)hydroxylamine
CAS No.:823-86-9
Molecular Weight:143.57
Molecular Formula:C15H17N3O3S (isomer)
Names and Identifiers
Synonyms

MCULE-6931012186 MOLPORT-009-126-669 n-[(2h-1,3-benzodioxol-5-yl)methyl]-2-(cyclopent-2-en-1-yl)-n-methylacetamide Z89612636

Inchi
InChI=1S/C6H6ClNO/c7-5-1-3-6(8-9)4-2-5/h1-4,8-9H
InChkey
VVQDMDRAUXFEND-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC=C1NO)Cl
Properties
Refractive Index
1.661
Computational chemical data
  • Molecular Weight:143.57g/mol
  • Molecular Formula:C15H17N3O3S
  • Compound Is Canonicalized:True
  • Exact Mass:143.014
  • Monoisotopic Mass:143.014
  • Complexity:81.1
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:32.3A^2
  • Heavy Atom Count:9
  • 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: AAADcYBiIAAEAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHAIUCAAACAqBECAwwIBQAACA ACRCQACCAAAgBwAoiAAAZogIICKBk5GAIABgkAAIyAcQAAAAAABAAAAAAAAAAIAAAAAAAAAAAAAA AA==
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