2-(Chloromethyl)-1,3-dioxolane
Properties
- Molecular formula
- C4H7ClO2
- Molar mass
- 122.55 g/mol
- Exact mass
- 122.0135 Da
- Boiling point
- 158 °C
- logP
- 0.60Crippen estimate
- Polar surface area
- 18.5 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
2568-30-1SMILES
ClCC1OCCO1InChIKey
IKZOMJGRWIOEDP-UHFFFAOYSA-NInChI
InChI=1S/C4H7ClO2/c5-3-4-6-1-2-7-4/h4H,1-3H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 1,3-Dioxolane, 2-(chloromethyl)-
- 2-Chloromethyldioxolane
- Chloroacetaldehyde ethylene glycol
- NSC 319115
Work with 2-(Chloromethyl)-1,3-dioxolane
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