| CAS Number | 954264-62-1 |
| Catalog Number | AG019X4G(AGN-PC-0WO9K9) |
| Chemical Name | 6-(Difluoromethoxy)-1,2,3,4-tetrahydroquinoline |
| IUPAC Name | 6-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline |
| InChI | InChI=1S/C10H11F2NO/c11-10(12)14-8-3-4-9-7(6-8)2-1-5-13-9/h3-4,6,10,13H,1-2,5H2 |
| InChI Key | DZDFJYGJGKTWJD-UHFFFAOYSA-N |
| MDL Number | MFCD09739659 |
| Molecular Formula | C10H11F2NO |
| Molecular Weight | 199.1972 |
| SMILES | FC(OC1=CC2=C(NCCC2)C=C1)F |
| Synonyms | 6-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline,
954264-62-1,
AC1Q4KQS,
SCHEMBL10913730,
CTK7B7471,
ZINC22222784,
AKOS000146589,
MCULE-9832330640,
NE35590,
EN300-54017,
Z818727298,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.201g/mol |
| Monoisotopic Mass | 199.081g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number