| CAS Number | 134391-57-4 |
| Catalog Number | AG009IQ9(AGN-PC-0WBZLG) |
| Chemical Name | 3-(Trifluoromethyl)-1H-indene |
| IUPAC Name | 3-(trifluoromethyl)-1H-indene |
| InChI | InChI=1S/C10H7F3/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5H2 |
| InChI Key | PCPRMODISMAALW-UHFFFAOYSA-N |
| MDL Number | MFCD11226532 |
| Molecular Formula | C10H7F3 |
| Molecular Weight | 184.1578 |
| SMILES | FC(C1=CCc2c1cccc2)(F)F |
| Synonyms | 3-(TRIFLUOROMETHYL)-1H-INDENE,
134391-57-4,
1-(trifluoromethyl)-3H-indene,
CTK7B6461,
C10H7F3,
3864AD,
BBL100758,
STL554552,
ZINC66329376,
AKOS005255616,
3-(Trifluoromethyl)-1H-indene, 95%,
TR-055188,
X-4040,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.161g/mol |
| Monoisotopic Mass | 184.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number