Cas no 89074-18-0 (Benzaldehyde, 4-(butylamino)-)

Benzaldehyde, 4-(butylamino)- structure
Benzaldehyde, 4-(butylamino)- structure
Product Name:Benzaldehyde, 4-(butylamino)-
CAS No:89074-18-0
MF:C11H15NO
MW:177.242902994156
CID:613527
PubChem ID:13184834
Update Time:2025-04-19

Benzaldehyde, 4-(butylamino)- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 4-(butylamino)-
    • 4-(butylamino)benzaldehyde
    • 89074-18-0
    • SCHEMBL5493605
    • DTXSID70525654
    • Inchi: 1S/C11H15NO/c1-2-3-8-12-11-6-4-10(9-13)5-7-11/h4-7,9,12H,2-3,8H2,1H3
    • InChI Key: ZNZMSBIJDNXMOP-UHFFFAOYSA-N
    • SMILES: O=CC1C=CC(=CC=1)NCCCC

Computed Properties

  • Exact Mass: 177.115364102g/mol
  • Monoisotopic Mass: 177.115364102g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 139
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 29.1?2
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