Hydroxytrimethylaminium
PubChem CID: 13148255
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| Compound Synonyms | Hydroxytrimethylaminium, hydroxy(trimethyl)azanium, hydroxytrimethylazanium, NoName_1678, hydroxy(trimethyl)ammonium, (CH3)3NOH, Trimethylamine N-oxide, 98%, DTXSID60902435, CHEBI:166856 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 5.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 28.4 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | hydroxy(trimethyl)azanium |
| Prediction Hob | 0.0 |
| Xlogp | -0.2 |
| Molecular Formula | C3H10NO+ |
| Prediction Swissadme | 0.0 |
| Inchi Key | LGHYUXIXXNHKSE-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.21 |
| Rotatable Bond Count | 0.0 |
| Logd | -1.467 |
| Compound Name | Hydroxytrimethylaminium |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 76.0762 |
| Formal Charge | 1.0 |
| Monoisotopic Mass | 76.0762 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 76.12 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -0.1796377999999999 |
| Inchi | InChI=1S/C3H10NO/c1-4(2,3)5/h5H,1-3H3/q+1 |
| Smiles | C[N+](C)(C)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ligusticum Sinense (Plant) Rel Props:Source_db:cmaup_ingredients