Cas no 102428-33-1 (4'-Butoxybenzylidene-4-cyanoaniline)

4'-Butoxybenzylidene-4-cyanoaniline structure
102428-33-1 structure
Product Name:4'-Butoxybenzylidene-4-cyanoaniline
CAS No:102428-33-1
MF:C18H18N2O
MW:278.348324298859
CID:217292
Update Time:2023-04-06

4'-Butoxybenzylidene-4-cyanoaniline Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile,4-[(E)-[(4-butoxyphenyl)methylene]amino]-
    • BBCA
    • Benzonitrile,4-[[(4-butoxyphenyl)methylene]amino]-, (E)-
    • Benzonitrile, 4-[(E)-[(4-butoxyphenyl)methylene]amino]-
    • 4'-Butoxybenzylidene-4-cyanoaniline
    • Inchi: 1S/C18H18N2O/c1-2-3-12-21-18-10-6-16(7-11-18)14-20-17-8-4-15(13-19)5-9-17/h4-11,14H,2-3,12H2,1H3/b20-14+
    • InChI Key: JWLPZJPDDBBWQD-XSFVSMFZSA-N
    • SMILES: C(#N)C1=CC=C(/N=C/C2=CC=C(OCCCC)C=C2)C=C1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 6
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