chempirical

Tetrahydro-2H-pyran-3-methanol

C6H12O2CAS 14774-36-8116.16 g/mol

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HOO
AlcoholEther

Properties

Molecular formula
C6H12O2
Molar mass
116.16 g/mol
Exact mass
116.0837 Da
Density
1.04 g/mL (at 20 °C)
Boiling point
68–69 °C (at 2 Torr)
logP
0.41Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
14774-36-8
SMILES
OCC1CCCOC1
InChIKey
VFTQJKSRDCKVQA-UHFFFAOYSA-N
InChI
InChI=1S/C6H12O2/c7-4-6-2-1-3-8-5-6/h6-7H,1-5H2

Weigh it out

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Names and synonyms

7 names
  • 2H-Pyran-3-methanol, tetrahydro-
  • Pyran-3-methanol, tetrahydro-
  • 3-(Hydroxymethyl)tetrahydropyran
  • (Tetrahydropyran-3-yl)methanol
  • 5-(Hydroxymethyl)tetrahydropyran
  • (Tetrahydro-2H-pyran-3-yl)methanol
  • Oxan-3-ylmethanol

Work with Tetrahydro-2H-pyran-3-methanol

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

(S)-Tetrahydrofuran-3-ylm...124391-75-973 % similar (Tetrahydro-2H-pyran-4-yl)methanol14774-37-950 % similar Cyclopentanemethanol3637-61-450 % similar Cyclobutanemethanol4415-82-150 % similar Cyclohexylmethanol100-49-248 % similar 2-Hexyl-1-decanol2425-77-643 % similar Octyldodecanol5333-42-643 % similar 2-Decyltetradecanol58670-89-643 % similar

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

Same formula

2-(Hydroxymethyl)tetrahydropyran100-72-1 3-Methylpentanoic acid105-43-1 sec-Butyl acetate105-46-4 Ethyl butyrate105-54-4 Propyl propanoate106-36-5 3,3-Dimethylbutanoic acid1070-83-3 Isobutyl acetate110-19-0 Isoamyl formate110-45-2

Elsewhere

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