2-Propyl-1,3,2-dioxazolidine
PubChem CID: 53754059
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| Compound Synonyms | SCHEMBL10582225 |
|---|---|
| Topological Polar Surface Area | 21.7 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 8.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 61.4 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-propyl-1,3,2-dioxazolidine |
| Prediction Hob | 1.0 |
| Xlogp | 1.0 |
| Molecular Formula | C5H11NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DDEGRJFTMSAWOG-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.726 |
| Rotatable Bond Count | 2.0 |
| Logd | 0.535 |
| Compound Name | 2-Propyl-1,3,2-dioxazolidine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 117.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 117.079 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 117.15 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.0769175999999998 |
| Inchi | InChI=1S/C5H11NO2/c1-2-3-6-7-4-5-8-6/h2-5H2,1H3 |
| Smiles | CCCN1OCCO1 |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Artemisia Argyi (Plant) Rel Props:Source_db:cmaup_ingredients