Cas no 3506-32-9 (1,2-Benzenediol,4-[2-[(1-methylethyl)amino]ethyl]-)

1,2-Benzenediol,4-[2-[(1-methylethyl)amino]ethyl]- structure
3506-32-9 structure
Product Name:1,2-Benzenediol,4-[2-[(1-methylethyl)amino]ethyl]-
CAS No:3506-32-9
MF:C11H17NO2
MW:195.258183240891
CID:314016
PubChem ID:151105
Update Time:2025-04-19

1,2-Benzenediol,4-[2-[(1-methylethyl)amino]ethyl]- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenediol,4-[2-[(1-methylethyl)amino]ethyl]-
    • 4-[2-(propan-2-ylamino)ethyl]benzene-1,2-diol
    • 1,2-Benzenediol, 4-(2-((1-methylethyl)amino)ethyl)-
    • DTXSID90188563
    • 3506-32-9
    • 1,2-Benzenediol, 4-[2-[(1-methylethyl)amino]ethyl]-
    • N-Isopropyldopamine
    • SCHEMBL3269173
    • SCHEMBL9132392
    • Inchi: 1S/C11H17NO2/c1-8(2)12-6-5-9-3-4-10(13)11(14)7-9/h3-4,7-8,12-14H,5-6H2,1-2H3
    • InChI Key: BZRDLWPJCCLNCX-UHFFFAOYSA-N
    • SMILES: OC1=C(C=CC(=C1)CCNC(C)C)O

Computed Properties

  • Exact Mass: 231.102607
  • Monoisotopic Mass: 231.102607
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 161
  • 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: 52.5
  • XLogP3: 0.3

Experimental Properties

  • Density: 1.098
  • Boiling Point: 345.5°Cat760mmHg
  • Flash Point: 135.5°C
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