| CAS Number | 389614-94-2 |
| Catalog Number | AG00C0VH(AGN-PC-0MXSCQ) |
| Chemical Name | EA4 |
| IUPAC Name | 7-chloro-6-[4-(diethylamino)phenyl]quinoline-5,8-dione |
| InChI | InChI=1S/C19H17ClN2O2/c1-3-22(4-2)13-9-7-12(8-10-13)15-16(20)19(24)17-14(18(15)23)6-5-11-21-17/h5-11H,3-4H2,1-2H3 |
| InChI Key | XAZVKSMDPVMMPP-UHFFFAOYSA-N |
| MDL Number | MFCD08457916 |
| Molecular Formula | C19H17ClN2O2 |
| Molecular Weight | 340.8035 |
| SMILES | CCN(CC)c1ccc(cc1)C1=C(Cl)C(=O)c2ncccc2C1=O |
| Synonyms | 389614-94-2,
7-CHLORO-6-[4-(DIETHYLAMINO)PHENYL]QUINOLINE-5,8-DIONE,
EA4,
SCHEMBL6661707,
CTK4I0751,
DTXSID20434702,
HMS3648C17,
ZINC27638719,
AKOS030554852,
ACM389614942,
SR-01000946198,
SR-01000946198-1,
5,8-Quinolinedione,7-chloro-6-[4-(diethylamino)phenyl]-,
XAZVKSMDPVMMPP-UHFFFAOYSA-N,
CID10042917,
7-chloro-6-(4-diethylaminophenyl)quinoline-5,8-dione,
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| Complexity | 534 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 340.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 340.807g/mol |
| Monoisotopic Mass | 340.098g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 50.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number