chempirical

3,3-Bisz-(hydroxymethyl)-oxetane

C5H10O3CAS 2754-18-9118.13 g/mol

Open in Covalent MOL file
OOHOH
AlcoholEther

Properties

Molecular formula
C5H10O3
Molar mass
118.13 g/mol
Exact mass
118.0630 Da
logP
-1.01Crippen estimate
Polar surface area
49.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Identifiers

CAS number
2754-18-9
SMILES
C1C(CO1)(CO)CO
InChIKey
QSGREIXRTDCBHO-UHFFFAOYSA-N
InChI
InChI=1S/C5H10O3/c6-1-5(2-7)3-8-4-5/h6-7H,1-4H2

Weigh it out

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

Names and synonyms

1 names
  • 3,3-Bis(hydroxymethyl)oxetane

Work with 3,3-Bisz-(hydroxymethyl)-oxetane

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

Dipentaerythritol126-58-987 % similar [3-(Bromomethyl)oxetan-3-yl]methanol22633-44-965 % similar OXT 1013047-32-365 % similar Pentaerythritol115-77-553 % similar Pentaerythritol triallyl ether1471-17-650 % similar 3-Methyl-3-oxetanemethanol3143-02-050 % similar 1,1-Cyclopropanedimethanol39590-81-347 % similar Dipentaerythritol pentaacrylate60506-81-242 % similar

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

Same formula

Diethyl carbonate105-58-8 Ethylene glycol monomethyl ether acetate110-49-6 (S)-2-Hydroxy-3-methylbutanoic acid17407-55-5 Methyl 2-hydroxyisobutyrate2110-78-3 (±)-2-Hydroxy-2-methylbutyric acid3739-30-8 Methyl 3-methoxypropionate3852-09-3 Ethyl 2-methoxyacetate3938-96-3 Methyl (-)-3-hydroxybutyrate3976-69-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook