Cas no 4026-05-5 (3-tert-butylbenzene-1,2-diol)

3-tert-butylbenzene-1,2-diol structure
3-tert-butylbenzene-1,2-diol structure
Product Name:3-tert-butylbenzene-1,2-diol
CAS No:4026-05-5
MF:C10H14O2
MW:166.216963291168
MDL:MFCD00515124
CID:333813
PubChem ID:77643
Update Time:2025-08-05

3-tert-butylbenzene-1,2-diol Chemical and Physical Properties

Names and Identifiers

    • 3-(tert-Butyl)benzene-1,2-diol
    • 1,2-Benzenediol,3-(1,1-dimethylethyl)-
    • 3-?(tert-?Butyl)?benzene-?1,?2-?diol
    • 3-t-butyl-catechol
    • 3-tert-b
    • 3-tert-butylbenzene-1,2-diol
    • 3-tert-Butyl-brenzcatechin
    • 3-tert-Butylcatechol
    • Carbamic acid, (1,1-dimethylethyl)-
    • CTK1J0762
    • ketocarboxylic acid N-tert.-butylamide
    • Kohlensaeure-mono-tert-butylamid
    • N-tert-butylcarbamate
    • tert-butyl(piperidin-4-ylmethyl)carbamate
    • Tert-butyl[naphthalene-1-sulfonyl]carbamate
    • tert-butyl-carbamic acid
    • tert-Butyl-carbamidsaeure
    • tert-butyl-catechol
    • tert-butyl-pyrocatechol
    • 3-tert-Butylpyrocatechol
    • Q27259050
    • SCHEMBL36109
    • EINECS 248-325-9
    • CS-W006764
    • 29863-27-2
    • 47F26P1WUE
    • EN300-1599500
    • tert.-butylcatechol
    • NS00049221
    • t-butylpyrocatechol
    • tert-Butylpyrocatechol
    • UNII-06J124VX0O
    • 1,2-Benzenediol, (1,1-dimethylethyl)-
    • W17828
    • 06J124VX0O
    • t-butylcatechol
    • 4026-05-5
    • JIGUICYYOYEXFS-UHFFFAOYSA-N
    • 1,2-Benzenediol, 3-(1,1-dimethylethyl)-
    • AS-58276
    • 3-(tert-Butyl)-1,2-benzenediol
    • AKOS016005287
    • PYROCATECHOL, 3-TERT-BUTYL-
    • MFCD00515124
    • tert-butyl catechol
    • SY104770
    • EINECS 223-695-4
    • DB-338978
    • 27213-78-1
    • DA-07446
    • tert-Butylcatechol
    • MDL: MFCD00515124
    • Inchi: 1S/C10H14O2/c1-10(2,3)7-5-4-6-8(11)9(7)12/h4-6,11-12H,1-3H3
    • InChI Key: JIGUICYYOYEXFS-UHFFFAOYSA-N
    • SMILES: OC1C(=CC=CC=1C(C)(C)C)O

Computed Properties

  • Exact Mass: 166.09942
  • Monoisotopic Mass: 166.09938
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 148
  • 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: 40.5
  • XLogP3: 2.9

Experimental Properties

  • Density: 1.086
  • Boiling Point: 266 oC
  • Flash Point: 123 oC
  • Refractive Index: 1.545
  • PSA: 40.46

3-tert-butylbenzene-1,2-diol Pricemore >>

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