| CAS Number | 1368766-25-9 |
| Catalog Number | AG01AJ9B(AGN-PC-0WO3WB) |
| Chemical Name | 5-FLUORO-2-METHYL-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE |
| IUPAC Name | 5-fluoro-2-methyl-3,4-dihydro-2H-naphthalen-1-one |
| InChI | InChI=1S/C11H11FO/c1-7-5-6-8-9(11(7)13)3-2-4-10(8)12/h2-4,7H,5-6H2,1H3 |
| InChI Key | FLDTXNMPWCQWKQ-UHFFFAOYSA-N |
| MDL Number | MFCD21602416 |
| Molecular Formula | C11H11FO |
| Molecular Weight | 178.2028 |
| SMILES | CC1C(=O)C2=C(C(=CC=C2)F)CC1 |
| Synonyms | 5-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-one,
1368766-25-9,
AKOS022532640,
MCULE-7765153065,
NE16734,
Z1335657412,
|
| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.206g/mol |
| Monoisotopic Mass | 178.079g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number