| CAS Number | 1082893-09-1 |
| Catalog Number | AG019WHL(AGN-PC-0WO4OT) |
| Chemical Name | 8-(Difluoromethoxy)quinolin-5-amine |
| IUPAC Name | 8-(difluoromethoxy)quinolin-5-amine |
| InChI | InChI=1S/C10H8F2N2O/c11-10(12)15-8-4-3-7(13)6-2-1-5-14-9(6)8/h1-5,10H,13H2 |
| InChI Key | IRUAVMYTXAUCEZ-UHFFFAOYSA-N |
| MDL Number | MFCD11557747 |
| Molecular Formula | C10H8F2N2O |
| Molecular Weight | 210.1801 |
| SMILES | NC1=C2C(N=CC=C2)=C(OC(F)F)C=C1 |
| Synonyms | 8-(difluoromethoxy)quinolin-5-amine,
1082893-09-1,
AC1Q51BP,
CTK7B7298,
8-(difluoromethoxy)-5-quinolylamine,
SBB076842,
ZINC19772685,
AKOS005136296,
MCULE-2466157919,
NE22414,
EN300-52004,
Z802671534,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.06g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.184g/mol |
| Monoisotopic Mass | 210.06g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number