| Sonrisas canónicas | C1CC(=O)C2=C(C=CC(=C21)F)F |
|---|---|
| IUPAC Name | 4,7-difluoro-2,3-dihydroinden-1-one |
| InChIKey | KMWBFTTYYGUTNW-UHFFFAOYSA-N |
| INCHI | 1S/C9H6F2O/c10-6-2-3-7(11)9-5(6)1-4-8(9)12/h2-3H,1,4H2 |
| Isómeros SMILES | C1CC(=O)C2=C(C=CC(=C21)F)F |
| Peso molecular | 168.14 |
| Reaxy-Rn | 9325335 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9325335&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Clase | Indanes |
| Subclass | Indanones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indanones |
| Alternative Parents | Aryl alkyl ketones Aryl fluorides Vinylogous halides Organofluorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Indanone - Aryl alkyl ketone - Aryl ketone - Aryl halide - Aryl fluoride - Vinylogous halide - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Aromatic homopolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane ring bearing a ketone group. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 H2423368 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423369 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423370 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423371 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423377 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423378 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423379 | Certificate of Analysis | May 13, 2024 | D190496 |
| H2423380 | Certificate of Analysis | May 13, 2024 | D190496 |
| Peso molecular | 168.140 g/mol |
|---|---|
| XLogP3 | 1.900 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 168.039 Da |
| Monoisotopic Mass | 168.039 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 205.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
