Cas no 82830-53-3 (1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine)

1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine structure
82830-53-3 structure
Product Name:1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine
CAS No:82830-53-3
MF:C11H16INO2
MW:321.154715538025
CID:1806864
PubChem ID:1229
Update Time:2025-04-21

1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Iodo-2,5-dimethoxyphenyl)-2-propanamine
    • SBB059624
    • CCRIS 157
    • 1,4,7,10-tetraoxa-cyclododecane
    • 1-(4-iodo-2,5-dimethoxy-phenyl)-2-aminopropane
    • (+/-)-1-(2,5-dimethoxy-4-iodophenyl)-2-aminopropane
    • [12]crown-4 ether
    • (+-)-1-(2,5-dimethoxy-4-iodophenyl)-2-aminopropane
    • BRN 1363064
    • [125I]-(+/-)-DOI
    • 12-Crown-4 ether
    • 12-Crown-4
    • Ethylene oxide cyclic tetramer
    • EOCT
    • EINECS 206-036-5
    • [12]-crown-4
    • (+/-)-1-[2,5-dimethoxy-4-iodophenyl]-2-aminopropane
    • +-2,5-DIMETHOXY-4-IODOAMPHETAMINE HYDROCHLORIDE
    • AKOS015965128
    • BGMZUEKZENQUJY-UHFFFAOYSA-
    • 1-(2,5-Dimethoxy-4-iodophenyl)-2-aminopropane
    • Racemic DOI
    • CHEBI:64629
    • DOI-P
    • 4-DOI
    • GTPL147
    • L000011
    • DTXSID7040520
    • PDSP1_001383
    • NCGC00015302-03
    • (+-)-DOI
    • 4-Iodo-2,5-dimethoxy-alpha-methylbenzeneethanamine
    • PDSP2_001367
    • SDCCGSBI-0050451.P002
    • 2,5-Dimethoxy-4-iodophenylisopropylamine
    • Benzeneethanamine, 4-iodo-2,5-dimethoxy-alpha-methyl-
    • 2,5-dimethoxy 4-iodoamphetamine
    • 1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amine
    • 4-Iodo-2,5-dimethoxyphenylisopropylamine
    • (+/-)-DOI
    • [125I]2,5-dimethoxy-4-iodoamphetamine
    • (+/-)-1-(4-iodo-2,5-dimethoxyphenyl)-2-aminopropane
    • 82830-53-3
    • InChI=1/C11H16INO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3
    • 4-Iodo-2,5-dimethoxyamphetamine
    • BGMZUEKZENQUJY-UHFFFAOYSA-N
    • F15177
    • NCGC00162163-01
    • UNII-OOM10GW9UE
    • 64584-34-5
    • NS00009810
    • CHEMBL6616
    • Lopac0_000466
    • SCHEMBL293580
    • NCGC00015302-04
    • CCG-204558
    • 2-(4-iodo-2,5-dimethoxyphenyl)-1-methylethylamine
    • DOI,(-)
    • DB-008006
    • DOI
    • J246.190K
    • [125I]4-iodo-2,5-dimethoxyphenylisopropylamine
    • DOI,(+)
    • OOM10GW9UE
    • 2,5-Dimethoxy-4-iodoamphetamine
    • Q209251
    • BENZENEETHANAMINE, 4-IODO-2,5-DIMETHOXY-.ALPHA.-METHYL-
    • Benzeneethanamine,?4-iodo-2,5-dimethoxy-.alpha.-methyl-
    • 1-(4-Iodo-2,5-dimethoxyphenyl)-2-aminopropane
    • BDBM28582
    • 1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine
    • Inchi： 1S/C11H16INO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3
    • InChI Key： BGMZUEKZENQUJY-UHFFFAOYSA-N
    • SMILES： IC1=CC(=C(C=C1OC)CC(C)N)OC

Computed Properties

  • Exact Mass: 321.02258g/mol
  • Monoisotopic Mass: 321.02258g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 191
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 44.5?2

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