| CAS Number | 1189107-49-0 |
| Catalog Number | AG0081KI(AGN-PC-0WR1N4) |
| Chemical Name | 4-Amino-7,8-difluoroquinoline |
| IUPAC Name | 7,8-difluoroquinolin-4-amine |
| InChI | InChI=1S/C9H6F2N2/c10-6-2-1-5-7(12)3-4-13-9(5)8(6)11/h1-4H,(H2,12,13) |
| InChI Key | ANZXGIJRDZNLHQ-UHFFFAOYSA-N |
| MDL Number | MFCD12674976 |
| Molecular Formula | C9H6F2N2 |
| Molecular Weight | 180.1541 |
| SMILES | Fc1ccc2c(c1F)nccc2N |
| Synonyms | 4-Amino-7,8-difluoroquinoline,
1189107-49-0,
7,8-Difluoroquinolin-4-amine,
CTK8E4807,
DTXSID80670922,
MFCD12674976,
ZINC36075573,
AKOS011471532,
DB-061454,
RT-016868,
FT-0757684,
T6262,
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.158g/mol |
| Monoisotopic Mass | 180.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number