Cas no 1176702-36-5 (2-Methyl-2-(3-methylphenyl)propan-1-amine)

2-Methyl-2-(3-methylphenyl)propan-1-amine structure
1176702-36-5 structure
Product Name:2-Methyl-2-(3-methylphenyl)propan-1-amine
CAS No:1176702-36-5
MF:C11H17N
MW:163.259382963181
CID:3165684
PubChem ID:47002400
Update Time:2025-04-21

2-Methyl-2-(3-methylphenyl)propan-1-amine Chemical and Physical Properties

Names and Identifiers

    • 2-Methyl-2-(3-methylphenyl)propan-1-amine
    • 1176702-36-5
    • EN300-59309
    • AKOS008143947
    • 887-986-3
    • G57000
    • BXB70236
    • Z725146606
    • Inchi: 1S/C11H17N/c1-9-5-4-6-10(7-9)11(2,3)8-12/h4-7H,8,12H2,1-3H3
    • InChI Key: QOIWNUGQGPTFRQ-UHFFFAOYSA-N
    • SMILES: NCC(C)(C)C1C=CC=C(C)C=1

Computed Properties

  • Exact Mass: 163.136
  • Monoisotopic Mass: 163.136
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 140
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26A^2
  • XLogP3: 2.5

Experimental Properties

  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 239.0±9.0 °C at 760 mmHg
  • Flash Point: 103.3±6.3 °C
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

2-Methyl-2-(3-methylphenyl)propan-1-amine Security Information

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