Cas no 94724-12-6 (Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl-)

Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl- structure
94724-12-6 structure
Product Name:Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl-
CAS No:94724-12-6
MF:C32H45N3O3
MW:519.718008756638
CID:798726
PubChem ID:2855
Update Time:2025-04-19

Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl-
    • COMPOUND 4880
    • 80 trihydrochloride
    • Compound 48
    • AKOS040758486
    • HY-115768
    • compound 48/80
    • 6IB
    • 94724-12-6
    • 2-[4-methoxy-3,5-bis[[2-methoxy-5-(2-methylaminoethyl)phenyl]methyl]phenyl]-N-methylethanamine
    • GTPL5531
    • CS-0255613
    • 2-[4-methoxy-3-[[2-methoxy-3-[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-5-[2-(methylamino)ethyl]phenyl]methyl]phenyl]-~{N}-methyl-ethanamine
    • DTXSID60915348
    • SCHEMBL14270291
    • 4-Methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methylbenzeneethanamine
    • Q27076663
    • Compound 48/80 trihydrochloride
    • HY-115768A
    • CS-1049097
    • Compound 48/80 (trimer)
    • DA-62450
    • Inchi: 1S/C32H45N3O3/c1-33-14-11-23-7-9-30(36-4)26(17-23)21-28-19-25(13-16-35-3)20-29(32(28)38-6)22-27-18-24(12-15-34-2)8-10-31(27)37-5/h7-10,17-20,33-35H,11-16,21-22H2,1-6H3
    • InChI Key: DXEVTBAWIGXNAW-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC(CCNC)=CC=1CC1C(=CC=C(CCNC)C=1)OC)CC1C(=CC=C(CCNC)C=1)OC

Computed Properties

  • Exact Mass: 519.346
  • Monoisotopic Mass: 519.346
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 9
  • Complexity: 742
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 63.8A^2

Experimental Properties

  • Color/Form: White or off white powder
  • Solubility: H2O: 50?mg/mL
  • Solubility: dissolve in water

Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl- Security Information

  • Hazardous Material transportation number:UN 2811 6.1/PG 2
  • WGK Germany:3
  • Hazard Category Code: 23/24/25
  • Safety Instruction: 22-24/25-45-36/37
  • FLUKA BRAND F CODES:3-8-10
  • Hazardous Material Identification: T
  • Storage Condition:2-8°C

Benzeneethanamine,4-methoxy-3,5-bis[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-N-methyl- Pricemore >>

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