1-Indanone
PubChem CID: 6735
Connections displayed (default: 10).
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| Compound Synonyms | 1-Indanone, 83-33-0, 2,3-Dihydro-1H-inden-1-one, Indan-1-one, INDANONE, 2,3-dihydroinden-1-one, alpha-Hydrindone, alpha-Indanone, 1-Indone, 1H-Inden-1-one, 2,3-dihydro-, Hydrindone, .alpha.-Indanone, .alpha.-Hydrindone, Indanone (VAN), MFCD00003785, 2,3-Dihydro-1-indenone, NSC 2581, NSC-2581, EINECS 201-470-1, 1H-INDAN-1-ONE, V7021Y717I, 1-OXOBENZOCYCLOPENTANE, AI3-11798, 30286-23-8, DTXSID1058892, CHEBI:17404, RASAGILINE METABOLITE, INDANONE, Indenone, dihydro-, 1-Hydroindone, alphaHydrindone, alphaIndanone, Indan1one, 1-Ketohydrindene, 1Indone, indane-1-one, indanone (1), Indanone-(1), dihydro-inden-1-one, 2,3Dihydro1Hinden1one, bmse000496, 1HInden1one, 2,3dihydro, 2,3-dihydro-inden-1-one, Indan-1-one (1-Indanone), SCHEMBL24746, Indan-1-one, Alpha-Indanone, SCHEMBL3694431, DTXCID6048331, UNII-V7021Y717I, CHEBI:38132, NSC2581, BCP19847, s9346, STK290968, AKOS000119606, AC-2464, CCG-321650, CS-W004333, FI00120, HY-W004333, PB48801, PS-5770, 1-Indanone, ReagentPlus(R), >=99%, 1-Indanone, purum, >=98.0% (GC), BP-12824, SY001380, DB-019218, 1-Indanone, Vetec(TM) reagent grade, 98%, I0013, NS00038249, EN300-21403, C01504, AH-034/32845037, Q15906439, F0001-2126, Z104495974, 1ON, 201-470-1 |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 151.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,3-dihydroinden-1-one |
| Prediction Hob | 1.0 |
| Xlogp | 1.7 |
| Molecular Formula | C9H8O |
| Prediction Swissadme | 0.0 |
| Inchi Key | QNXSIUBBGPHDDE-UHFFFAOYSA-N |
| Fcsp3 | 0.2222222222222222 |
| Logs | -2.697 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.032 |
| Compound Name | 1-Indanone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 132.058 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 132.058 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 132.16 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.1555044 |
| Inchi | InChI=1S/C9H8O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2 |
| Smiles | C1CC(=O)C2=CC=CC=C21 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aconitum Chasmanthum (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Artemisia Lactiflora (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Attalea Excelsa (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Catalpa Ovata (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Citrus Hassaku (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Coutarea Latifolia (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Crepidiastrum Sonchifolium (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Dipsacus Asper (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Duguetia Calycina (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Eriostemon Spicatus (Plant) Rel Props:Source_db:cmaup_ingredients - 11. Outgoing r'ship
FOUND_INto/from Garcinia Pyrifera (Plant) Rel Props:Source_db:cmaup_ingredients - 12. Outgoing r'ship
FOUND_INto/from Greenwayodendron Oliveri (Plant) Rel Props:Source_db:cmaup_ingredients - 13. Outgoing r'ship
FOUND_INto/from Hymenothrix Wislizenii (Plant) Rel Props:Source_db:cmaup_ingredients - 14. Outgoing r'ship
FOUND_INto/from Jacaranda Chelonia (Plant) Rel Props:Source_db:cmaup_ingredients - 15. Outgoing r'ship
FOUND_INto/from Ophryosporus Floribundus (Plant) Rel Props:Source_db:cmaup_ingredients - 16. Outgoing r'ship
FOUND_INto/from Payena Lucida (Plant) Rel Props:Source_db:cmaup_ingredients - 17. Outgoing r'ship
FOUND_INto/from Phalaris Canariensis (Plant) Rel Props:Source_db:cmaup_ingredients - 18. Outgoing r'ship
FOUND_INto/from Plumbagella Micrantha (Plant) Rel Props:Source_db:cmaup_ingredients - 19. Outgoing r'ship
FOUND_INto/from Prunus Mume (Plant) Rel Props:Source_db:cmaup_ingredients - 20. Outgoing r'ship
FOUND_INto/from Pteridium Aquilinum (Plant) Rel Props:Source_db:cmaup_ingredients - 21. Outgoing r'ship
FOUND_INto/from Rivina Humilis (Plant) Rel Props:Source_db:cmaup_ingredients - 22. Outgoing r'ship
FOUND_INto/from Samadera Indica (Plant) Rel Props:Source_db:cmaup_ingredients - 23. Outgoing r'ship
FOUND_INto/from Tanacetum Parthenifolium (Plant) Rel Props:Source_db:cmaup_ingredients