Cas no 1185304-11-3 (Benzo[1,3]dioxol-5-ylmethyl-(3-methoxy-benzyl)-amine hydrochloride)

Benzo[1,3]dioxol-5-ylmethyl-(3-methoxy-benzyl)-amine hydrochloride structure
1185304-11-3 structure
Product Name:Benzo[1,3]dioxol-5-ylmethyl-(3-methoxy-benzyl)-amine hydrochloride
CAS No:1185304-11-3
MF:C16H18ClNO3
MW:307.772023677826
CID:1078101
PubChem ID:46736397
Update Time:2025-04-20

Benzo[1,3]dioxol-5-ylmethyl-(3-methoxy-benzyl)-amine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Benzo[1,3]dioxol-5-ylmethyl-(3-methoxy-benzyl)-amine hydrochloride
    • N-(1,3-benzodioxol-5-ylmethyl)-1-(3-methoxyphenyl)methanamine;hydrochloride
    • (2H-1,3-benzodioxol-5-ylmethyl)[(3-methoxyphenyl)methyl]amine hydrochloride
    • 1185304-11-3
    • AKOS015848771
    • Inchi: 1S/C16H17NO3.ClH/c1-18-14-4-2-3-12(7-14)9-17-10-13-5-6-15-16(8-13)20-11-19-15;/h2-8,17H,9-11H2,1H3;1H
    • InChI Key: ADKAJCRYFFLCCX-UHFFFAOYSA-N
    • SMILES: Cl.O1COC2=CC=C(C=C12)CNCC1C=CC=C(C=1)OC

Computed Properties

  • Exact Mass: 307.0975211g/mol
  • Monoisotopic Mass: 307.0975211g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 299
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 39.7?2
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