Tripentylphosphine oxide
PubChem CID: 99394
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| Compound Synonyms | Tripentylphosphine oxide, 3084-47-7, Phosphine oxide, tripentyl-, TRI-n-AMYL PHOSPHINE OXIDE, 1-dipentylphosphorylpentane, L2CM9LE7JJ, NSC 222422, BRN 1774351, TRI-N-AMYLPHOSPHINEOXIDE, NSC-222422, DTXSID40184853, NSC222422, UNII-L2CM9LE7JJ, diamyl amyl phosphine oxide, 1-(dipentylphosphoryl)pentane, SCHEMBL621623, DTXCID80107344, WLN: OP5&5&5, AKOS003625102, DB-047915 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Hydrocarbons |
| Deep Smiles | CCCCCP=O)CCCCC)))))CCCCC |
| Heavy Atom Count | 17.0 |
| Classyfire Class | Organic phosphines and derivatives |
| Classyfire Subclass | Organophosphine oxides |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 168.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-dipentylphosphorylpentane |
| Veber Rule | False |
| Classyfire Superclass | Organophosphorus compounds |
| Xlogp | 4.8 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C15H33OP |
| Inchi Key | SAIZTOCXWYRRNW-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 12.0 |
| Synonyms | lupeol palmitate |
| Esol Class | Soluble |
| Functional Groups | CP(C)(C)=O |
| Compound Name | Tripentylphosphine oxide |
| Exact Mass | 260.227 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 260.227 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 260.399 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C15H33OP/c1-4-7-10-13-17(16,14-11-8-5-2)15-12-9-6-3/h4-15H2,1-3H3 |
| Smiles | CCCCCP(=O)(CCCCC)CCCCC |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Cheilocostus Speciosus (Plant) Rel Props:Reference:ISBN:9788185042084 - 2. Outgoing r'ship
FOUND_INto/from Cyanthillium Cinereum (Plant) Rel Props:Reference:ISBN:9788171360536 - 3. Outgoing r'ship
FOUND_INto/from Inula Grantioides (Plant) Rel Props:Reference:ISBN:9788172362300; ISBN:9788185042145