chempirical

tert-Butyl alcohol

C4H10OCAS 75-65-074.12 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C4H10O
Molar mass
74.12 g/mol
Exact mass
74.0732 Da
Density
0.8 g/mL
Melting point
25.7 °C
Boiling point
82.41 °C
logP
0.78Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
75-65-0
SMILES
CC(C)(C)O
InChIKey
DKGAVHZHDRPRBM-UHFFFAOYSA-N
InChI
InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3

Weigh it out

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

Names and synonyms

9 names
  • 2-Propanol, 2-methyl-
  • 2-Methyl-2-propanol
  • tert-Butanol
  • 1,1-Dimethylethanol
  • Trimethylcarbinol
  • Trimethylmethanol
  • t-Butanol
  • 2-Hydroxy-2-methylpropane
  • tert-Bu-OH

Work with tert-Butyl alcohol

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

tert-Butyl titanate3087-39-675 % similar Pinacol76-09-538 % similar 2,5-Dimethyl-2,5-hexanediol110-03-231 % similar 2,5-Dimethyl-3-hexyne-2,5-diol142-30-331 % similar

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

Same formula

(-)-2-Butanol14898-79-4 (±)-2-Butanol15892-23-6 (+)-2-Butanol4221-99-2 Methoxypropane557-17-5 2-Methoxypropane598-53-8 Diethyl ether60-29-7 1-Butanol71-36-3 Isobutanol78-83-1

Elsewhere

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