Cas no 116233-13-7 (3,4-bis(propan-2-yl)aniline)

3,4-bis(propan-2-yl)aniline structure
3,4-bis(propan-2-yl)aniline structure
Product Name:3,4-bis(propan-2-yl)aniline
CAS No:116233-13-7
MF:C12H19N
MW:177.28596329689
MDL:MFCD09746435
CID:131134
PubChem ID:14186440
Update Time:2025-09-23

3,4-bis(propan-2-yl)aniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine,3,4-bis(1-methylethyl)-
    • 3,4-BIS(1-METHYLETHYL)-BENZENAMINE
    • 3,4-di(propan-2-yl)aniline
    • 3,4-bis(propan-2-yl)aniline
    • 3,4-Diisopropylaniline
    • EN300-2578531
    • AKOS005266430
    • DTXSID80557143
    • SCHEMBL2379856
    • MFCD09746435
    • Benzenamine, 3,4-bis(1-methylethyl)-
    • 3,4-di-isopropylphenyl-amine
    • 116233-13-7
    • SY293398
    • MDL: MFCD09746435
    • Inchi: 1S/C12H19N/c1-8(2)11-6-5-10(13)7-12(11)9(3)4/h5-9H,13H2,1-4H3
    • InChI Key: YQBCQWYZOXZDAI-UHFFFAOYSA-N
    • SMILES: NC1C=CC(C(C)C)=C(C=1)C(C)C

Computed Properties

  • Exact Mass: 177.15187
  • Monoisotopic Mass: 177.151749610g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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
  • XLogP3: 3.5
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.02

3,4-bis(propan-2-yl)aniline Pricemore >>

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