Trimethylsilyl 2-pentadecyl-6-((trimethylsilyl)oxy)benzoate
PubChem CID: 91745705
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| Compound Synonyms | Hydroginkgolic acid (2TMS), Cyclogallipharic acid (2TMS), DBCCHENOJSNWKO-UHFFFAOYSA-N, (15:0)-Anacardic acid (2TMS), Salicylic acid, 6-pentadecyl- (2TMS), 2-Hydroxy-6-pentadecylbenzoic acid (2TMS), Benzoic acid, 2-hydroxy-6-pentadecyl- (2TMS), Trimethylsilyl 2-pentadecyl-6-((trimethylsilyl)oxy)benzoate |
|---|---|
| Topological Polar Surface Area | 35.5 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 33.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 510.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | trimethylsilyl 2-pentadecyl-6-trimethylsilyloxybenzoate |
| Prediction Hob | 0.0 |
| Molecular Formula | C28H52O3Si2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DBCCHENOJSNWKO-UHFFFAOYSA-N |
| Fcsp3 | 0.75 |
| Logs | -7.865 |
| Rotatable Bond Count | 19.0 |
| Logd | 6.541 |
| Compound Name | Trimethylsilyl 2-pentadecyl-6-((trimethylsilyl)oxy)benzoate |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 492.345 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 492.345 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 492.9 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C28H52O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-23-21-24-26(30-32(2,3)4)27(25)28(29)31-33(5,6)7/h21,23-24H,8-20,22H2,1-7H3 |
| Smiles | CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O[Si](C)(C)C)C(=O)O[Si](C)(C)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ginkgo Biloba (Plant) Rel Props:Source_db:cmaup_ingredients