Cas no 3123-93-1 (3-Hexene, 2,2-dimethyl-)

3-Hexene, 2,2-dimethyl- structure
3-Hexene, 2,2-dimethyl- structure
Product Name:3-Hexene, 2,2-dimethyl-
CAS No:3123-93-1
MF:C8H16
MW:112.212642669678
CID:310203
PubChem ID:5357261
Update Time:2025-04-19

3-Hexene, 2,2-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Hexene, 2,2-dimethyl-
    • TRANS-2,2-DIMETHYL-3-HEXENE
    • 2,2-dimethyl-3-hexen
    • 2,2-Dimethyl-3-hexene
    • 2,2-Dimethyl-3-hexene trans
    • 2,2-dimethylhex-3-ene
    • 2,2-Dimethylhexene-3
    • 3-hexene,2,2-dimethyl
    • 5,5-dimethyl-3-hexene
    • Einecs 221-504-9
    • NSC 74166
    • 690-93-7
    • AKOS024429418
    • DTXSID9062853
    • 3123-93-1
    • (E)-2,2-Dimethyl 3-hexene
    • JPLZSSHKQZJYTJ-VOTSOKGWSA-N
    • 2,2-Dimethyl-trans-3-hexene
    • NSC-74166
    • (E)-2,2-dimethylhex-3-ene
    • NSC74166
    • 3-Hexene, 2,2-dimethyl-, (E)-
    • (3E)-2,2-Dimethyl-3-hexene
    • 3-Hexene,2-dimethyl-, (E)-
    • (E)-2,2-Dimethyl-3-hexene
    • DTXSID40896843
    • Inchi: 1S/C8H16/c1-5-6-7-8(2,3)4/h6-7H,5H2,1-4H3/b7-6+
    • InChI Key: JPLZSSHKQZJYTJ-VOTSOKGWSA-N
    • SMILES: C(/C=C/CC)(C)(C)C

Computed Properties

  • Exact Mass: 112.12500
  • Monoisotopic Mass: 112.125201
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 72.5
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0
  • XLogP3: 3.4

Experimental Properties

  • Density: 0.727
  • Boiling Point: 105.5°Cat760mmHg
  • Flash Point: 8.4°C
  • Refractive Index: 1.421
  • PSA: 0.00000
  • LogP: 2.99870
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