2,3-Dihydro-5-hydroxyindol-2-one
PubChem CID: 76955
Connections displayed (default: 10).
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| Compound Synonyms | 5-Hydroxyoxindole, 3416-18-0, 5-hydroxyindolin-2-one, 5-hydroxy-1,3-dihydroindol-2-one, 2,3-Dihydro-5-hydroxyindol-2-one, 5-Hydroxy-1,3-dihydro-indol-2-one, MFCD00014566, 5-HYDROXY-2-OXYINDOLE, 5-Hydroxy-1,3-dihydro-2H-indol-2-one, EINECS 222-309-1, 5-hydroxy-2,3-dihydro-1H-indol-2-one, 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-, DTXSID20187761, 2-Indolinone, 5-hydroxy-, 5-hydroxy-oxindole, 5-hydroxyindolinone, 5-Hydroxy-2-oxindole, SCHEMBL19391, 5-hydroxyoxindole, AldrichCPR, CHEMBL3093623, EX-A7998G, DTXCID80110252, CHEBI:230711, BCP27895, AKOS005258613, AC-1914, CS-W001542, FH52473, GS-3807, HY-W001542, SB64276, PD171601, SY031204, 5-Hydroxy-1,3-dihydro-2H-indol-2-one #, DB-007060, NS00029620, EN300-177590, H57005, AR-683/41718240, Z1198147431, 222-309-1 |
|---|---|
| Topological Polar Surface Area | 49.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 181.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-hydroxy-1,3-dihydroindol-2-one |
| Prediction Hob | 1.0 |
| Xlogp | 0.8 |
| Molecular Formula | C8H7NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZGTUSQAQXWSMDW-UHFFFAOYSA-N |
| Fcsp3 | 0.125 |
| Logs | -2.422 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.606 |
| Compound Name | 2,3-Dihydro-5-hydroxyindol-2-one |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 149.048 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 149.048 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 149.15 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.6723601636363636 |
| Inchi | InChI=1S/C8H7NO2/c10-6-1-2-7-5(3-6)4-8(11)9-7/h1-3,10H,4H2,(H,9,11) |
| Smiles | C1C2=C(C=CC(=C2)O)NC1=O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Isatis Tinctoria (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Persicaria Tinctoria (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all