Nitric acid
PubChem CID: 18529172
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | .beta.-Pilocarpidine, nitrate, HMS3370H19, BCP30675, NSC93129, NSC366217, AKOS024288012, NITRIC ACID, XI,XI-PILOCARPINE, NSC-366217, PD055713, 2(3H)-Furanone, (3R-trans)-, mononitrate, P0399, Nitrate, Pilocarpine, Isoptocarpine, Pilocarpine Mononitrate, (3S-cis)-Isomer |
|---|---|
| Topological Polar Surface Area | 110.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 269.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one, nitric acid |
| Prediction Hob | 1.0 |
| Molecular Formula | C11H17N3O5 |
| Prediction Swissadme | 1.0 |
| Inchi Key | PRZXEPJJHQYOGF-UHFFFAOYSA-N |
| Fcsp3 | 0.6363636363636364 |
| Logs | -0.939 |
| Rotatable Bond Count | 3.0 |
| Logd | 0.849 |
| Compound Name | Nitric acid, XI,XI-pilocarpine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 271.117 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 271.117 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 271.27 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.701329442105263 |
| Inchi | InChI=1S/C11H16N2O2.HNO3/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2, 2-1(3)4/h5,7-8,10H,3-4,6H2,1-2H3, (H,2,3,4) |
| Smiles | CCC1C(COC1=O)CC2=CN=CN2C.[N+](=O)(O)[O-] |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Cocculus Indicus (Plant) Rel Props:Source_db:cmaup_ingredients