chempirical

2-Methyl-2-pentanol

C6H14OCAS 590-36-3102.18 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C6H14O
Molar mass
102.18 g/mol
Exact mass
102.1045 Da
Density
0.835 g/mL (at 15.5 °C)
Melting point
−103 °C
Boiling point
121.1 °C
logP
1.56Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
590-36-3
SMILES
CCCC(C)(C)O
InChIKey
WFRBDWRZVBPBDO-UHFFFAOYSA-N
InChI
InChI=1S/C6H14O/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3

Weigh it out

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

Names and synonyms

9 names
  • 2-Pentanol, 2-methyl-
  • 2-Hydroxy-2-methylpentane
  • 1,1-Dimethylbutanol
  • 2-Methyl-2-hydroxypentane
  • 1,1-Dimethyl-1-butanol
  • 2-Methyl-2-amyl alcohol
  • NSC 8686
  • 4-Hydroxy-4-methylpentane
  • 4-Methyl-4-pentanol

Work with 2-Methyl-2-pentanol

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-Methyl-2-hexanol625-23-074 % similar 2,5-Dimethyl-2,5-hexanediol110-03-265 % similar 3-Methyl-1,3-butanediol2568-33-452 % similar tert-Amyl alcohol75-85-450 % similar 2-Methyl-4-phenyl-2-butanol103-05-946 % similar 4,7-Dimethyl-5-decyn-4,7-diol126-87-446 % similar 2,5-Dimethyl-2-hexanol3730-60-746 % similar 4,4-Dimethyl heptane1068-19-545 % similar

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

Same formula

2-Methyl-1-pentanol105-30-6 4-Methyl-2-pentanol108-11-2 Diisopropyl ether108-20-3 1-Hexanol111-27-3 Di-N-propyl ether111-43-3 Pinacolyl alcohol464-07-3 2-Methyl-3-pentanol565-67-3 3-Methyl-1-pentanol589-35-5

Elsewhere

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