chempirical

tert-Butylhydroquinone

C10H14O2CAS 1948-33-0166.22 g/mol

Open in Covalent MOL file
OHHO
Phenol

Properties

Molecular formula
C10H14O2
Molar mass
166.22 g/mol
Exact mass
166.0994 Da
Melting point
126.5–128.5 °C
logP
2.40Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
1948-33-0
SMILES
CC(C)(C)c1cc(O)ccc1O
InChIKey
BGNXCDMCOKJUMV-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,11-12H,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

29 names · show all
  • Mono-tert-butylhydroquinone
  • 1,4-Benzenediol, 2-(1,1-dimethylethyl)-
  • Hydroquinone, tert-butyl-
  • 2-(1,1-Dimethylethyl)-1,4-benzenediol
  • 2-tert-Butylhydroquinone
  • tert-Butyl-1,4-benzenediol
  • TBHQ
  • MTBHQ
  • Mono-tertiarybutylhydroquinone
  • t-Butylhydroquinone
  • 2-tert-Butyl-1,4-benzenediol
  • 2-(1,1-Dimethylethyl)hydroquinone
  • 2-(tert-Butyl)-p-hydroquinone
  • Banox 20BA
  • Tenox TBHQ
  • 2-tert-Butyl-1,4-hydroquinone
  • 2-tert-Butyl-1,4-dihydroxybenzene
  • Tenox 20
  • NSC 4972
  • Keniox 20
  • tert-Butyldihydroxybenzene
  • 2-t-Butylhydroquinone
  • MC-TB 20
  • Grindox 450
  • Grindox 204
  • tert-Butyl-1,4-dihydroxybenzene
  • 2-tert-Butyl-4-hydroxyphenol
  • Stearer TBH
  • PI 172

Work with tert-Butylhydroquinone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Di-tert-butylphenol96-76-464 % similar 2-tert-Butyl-4-methylphenol2409-55-462 % similar 2,5-Di-tert-butylhydroquinone88-58-460 % similar 3-tert-Butyl-4-hydroxyanisole121-00-656 % similar 2-tert-Butyl-4-ethylphenol96-70-856 % similar 2-tert-Butylphenol88-18-654 % similar Hydroxyquinol533-73-350 % similar Methylhydroquinone95-71-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Phenylacetaldehyde dimethyl acetal101-48-4 (-)-Camphorquinone10334-26-6 Camphorquinone10373-78-1 4-Butoxyphenol122-94-1 1,4-Diethoxybenzene122-95-2 2-Hexanoylfuran14360-50-0 Hexahydro-2,5-methanopentalene-3A(1H)-carboxylic acid16200-53-6 4-Butylresorcinol18979-61-8

Elsewhere

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