Cas no 2819-86-5 (Phenol,2,3,4,5,6-pentamethyl-)

Phenol,2,3,4,5,6-pentamethyl- structure
Phenol,2,3,4,5,6-pentamethyl- structure
Product Name:Phenol,2,3,4,5,6-pentamethyl-
CAS No:2819-86-5
MF:C11H16O
MW:164.244143486023
CID:260440
PubChem ID:17783
Update Time:2025-04-19

Phenol,2,3,4,5,6-pentamethyl- Chemical and Physical Properties

Names and Identifiers

    • Phenol,2,3,4,5,6-pentamethyl-
    • 2,3,4,5,6-Pentamethylphenol
    • HSDB 5900
    • NSC 46449
    • Pentamethylphenol
    • Phenol, pentamethyl-
    • NSC-46449
    • NS00028438
    • 2,3,4,5,6-pentamethyl-phenol
    • AKOS002945293
    • EINECS 220-580-0
    • UNII-TP4085FL43
    • TP4085FL43
    • PENTAMETHYLPHENOL [HSDB]
    • NSC46449
    • EN300-3187585
    • DTXSID8062654
    • Q27290092
    • 2819-86-5
    • Phenol, 2,3,4,5,6-pentamethyl-
    • SCHEMBL397768
    • Inchi: 1S/C11H16O/c1-6-7(2)9(4)11(12)10(5)8(6)3/h12H,1-5H3
    • InChI Key: WALBTDFSFTVXII-UHFFFAOYSA-N
    • SMILES: OC1C(C)=C(C)C(C)=C(C)C=1C

Computed Properties

  • Exact Mass: 164.12018
  • Monoisotopic Mass: 164.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 139
  • 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: 3.4
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23

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