| CAS Number | 953714-92-6 |
| Catalog Number | AG01AGY4(AGN-PC-0WO8PV) |
| Chemical Name | 5-fluoro-8-methyl-1,2,3,4-tetrahydroquinoline |
| IUPAC Name | 5-fluoro-8-methyl-1,2,3,4-tetrahydroquinoline |
| InChI | InChI=1S/C10H12FN/c1-7-4-5-9(11)8-3-2-6-12-10(7)8/h4-5,12H,2-3,6H2,1H3 |
| InChI Key | XXECYMKZLJNSOX-UHFFFAOYSA-N |
| MDL Number | MFCD09735296 |
| Molecular Formula | C10H12FN |
| Molecular Weight | 165.2074 |
| SMILES | CC1=C2C(CCCN2)=C(F)C=C1 |
| Synonyms | 5-fluoro-8-methyl-1,2,3,4-tetrahydroquinoline,
953714-92-6,
AC1Q2GPM,
ZINC22212750,
AKOS000143670,
MCULE-3263237568,
NE14346,
EN300-73148,
Z1266827401,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.211g/mol |
| Monoisotopic Mass | 165.095g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number