1-(1-Ethoxyethoxy)propane
PubChem CID: 30220
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| Compound Synonyms | 1-(1-Ethoxyethoxy)propane, 20680-10-8, 1-ETHOXY-1-PROPOXYETHANE, Propane, 1-(1-ethoxyethoxy)-, Acetaldehyde ethyl propyl acetal, Acetaldehyde, ethyl propyl acetal, R57Y77S7R5, EINECS 243-963-4, ETHYL PROPYL ACETAL, AI3-38086, DTXSID30864955, ETHANE, 1-ETHOXY-1-PROPOXY-, 1?-?(1-Ethoxyethoxy)?propane, Ethane, 1-ethoxy-1-propoxy, UNII-R57Y77S7R5, SCHEMBL3504284, DTXCID00813415, DB-310804, NS00051472, 1-Ethoxy-1-propoxyethane, Ethyl Propyl Acetal, , 243-963-4 |
|---|---|
| Topological Polar Surface Area | 18.5 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 54.9 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-(1-ethoxyethoxy)propane |
| Prediction Hob | 1.0 |
| Xlogp | 1.4 |
| Molecular Formula | C7H16O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | XKPTXCDASJWOLK-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -1.224 |
| Rotatable Bond Count | 5.0 |
| Logd | 1.405 |
| Compound Name | 1-(1-Ethoxyethoxy)propane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 132.115 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 132.115 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 132.2 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.1927586 |
| Inchi | InChI=1S/C7H16O2/c1-4-6-9-7(3)8-5-2/h7H,4-6H2,1-3H3 |
| Smiles | CCCOC(C)OCC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Pterocarpus Indicus (Plant) Rel Props:Source_db:cmaup_ingredients