2-tert-Butyl-6-methylphenol
Properties
- Molecular formula
- C11H16O
- Molar mass
- 164.25 g/mol
- Exact mass
- 164.1201 Da
- Density
- 0.9957 g/mL (at 20 °C)
- Melting point
- 31 °C
- Boiling point
- 230 °C
- logP
- 3.00Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage30.6% of notifiers
Aggregated from 134 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501
Identifiers
CAS number
2219-82-1SMILES
Cc1cccc(C(C)(C)C)c1OInChIKey
BKZXZGWHTRCFPX-UHFFFAOYSA-NInChI
InChI=1S/C11H16O/c1-8-6-5-7-9(10(8)12)11(2,3)4/h5-7,12H,1-4H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- Phenol, 2-(1,1-dimethylethyl)-6-methyl-
- o-Cresol, 6-tert-butyl-
- 2-(1,1-Dimethylethyl)-6-methylphenol
- 2-Methyl-6-tert-butylphenol
- 6-tert-Butyl-o-cresol
- 6-tert-Butyl-2-methylphenol
- 4-Hydroxy-3-methyl-5-tert-butylbenzol
- NSC 78461
Work with 2-tert-Butyl-6-methylphenol
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2,6-Di-tert-butylphenol128-39-272 % similar
Poly(P-phenylene oxide)25134-01-460 % similar
2,6-Xylenol576-26-160 % similar
2,4-Dimethyl-6-tert-butylphenol1879-09-053 % similar
3-tert-Butyl-2-hydroxybenzaldehyde24623-65-253 % similar
3-Methylcatechol488-17-552 % similar
2-Bromo-6-methylphenol13319-71-650 % similar
2-Chloro-6-methylphenol87-64-950 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds