Methylselenic acid
PubChem CID: 161597
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| Compound Synonyms | Methaneseleninic acid, Methylselenic acid, Methylseleninic acid, 28274-57-9, Methaneseleninic acid(6CI,8CI,9CI), methylseleninate, CHEBI:77012, UNII-9900C6V162, METHYLHYDROXY SELENOXIDE, 9900C6V162, DTXSID9040550, NSC-243621, NSC-244776, J1.001.675D, Methyl seleninic acid, Methyl selenic acid, Methaneseleninic acid, 95%, SCHEMBL772883, CHEMBL399906, DTXCID7020550, AKOS025296197, NS00125625, C18902, G78583, Q6823570, 608-183-4 |
|---|---|
| Topological Polar Surface Area | 37.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 4.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 33.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | n.a. |
| Iupac Name | methaneseleninic acid |
| Prediction Hob | 1.0 |
| Molecular Formula | CH4O2Se |
| Prediction Swissadme | 0.0 |
| Inchi Key | UEQANLFPOFICBH-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.958 |
| Rotatable Bond Count | 0.0 |
| Logd | -0.917 |
| Compound Name | Methylselenic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 127.938 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 127.938 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 127.01 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/CH4O2Se/c1-4(2)3/h1H3,(H,2,3) |
| Smiles | C[Se](=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Allium Sativum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all