Sodium Undecylenate
PubChem CID: 23667258
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| Compound Synonyms | SODIUM UNDECYLENATE, 3398-33-2, Sodium undec-10-enoate, Undecylenic Acid Sodium Salt, sodium, undec-10-enoate, UNII-V50TG7E11W, V50TG7E11W, 10-Undecenoic acid, sodium salt, EINECS 222-264-8, 10-Undecenoic, sodium salt, Sodium 10-undecenoate, AI3-19721, DTXSID4037039, 10-Hendecenoic acid, sodium salt, SODIUM UNDECYLENATE [VANDF], NSC 2836, NSC-2836, SODIUM UNDECYLENATE [WHO-DD], SODIUM DERIVATIVE OF 10-UNDECENOATE, NSC2836, Sodium undec10enoate, starbld0005771, 10Undecenoic, sodium salt, SCHEMBL78501, Sodium undecylenate, AldrichCPR, DTXCID2017039, DKYPZNSPQXLRRQ-UHFFFAOYSA-M, SODIUM UNDECYLENATE [INCI], HY-W127452, 10-Undecenoic acid, sodium salt (1:1), CS-0185683, NS00083608, Q18212200, 682-768-2 |
|---|---|
| Topological Polar Surface Area | 40.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 14.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 146.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | sodium, undec-10-enoate |
| Prediction Hob | 1.0 |
| Molecular Formula | C11H19NaO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DKYPZNSPQXLRRQ-UHFFFAOYSA-M |
| Fcsp3 | 0.7272727272727273 |
| Logs | -3.135 |
| Rotatable Bond Count | 9.0 |
| Logd | 2.222 |
| Compound Name | Sodium Undecylenate |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 206.128 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 206.128 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 206.26 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C11H20O2.Na/c1-2-3-4-5-6-7-8-9-10-11(12)13, /h2H,1,3-10H2,(H,12,13), /q, +1/p-1 |
| Smiles | C=CCCCCCCCCC(=O)[O-].[Na+] |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Angelica Dahurica (Plant) Rel Props:Source_db:cmaup_ingredients