| CAS Number | 946784-67-4 |
| Catalog Number | AG006T7E(AGN-PC-0WB3Y2) |
| Chemical Name | 6-Chloro-2-(chloromethyl)-4(1H)-quinolinone |
| IUPAC Name | 6-chloro-2-(chloromethyl)-1H-quinolin-4-one |
| InChI | InChI=1S/C10H7Cl2NO/c11-5-7-4-10(14)8-3-6(12)1-2-9(8)13-7/h1-4H,5H2,(H,13,14) |
| InChI Key | SDQWGYBBKOOUMC-UHFFFAOYSA-N |
| MDL Number | MFCD11053911 |
| Molecular Formula | C10H7Cl2NO |
| Molecular Weight | 228.0747 |
| SMILES | C12=CC(Cl)=CC=C1NC(=CC2=O)CCl |
| Synonyms | 6-CHLORO-2-(CHLOROMETHYL)-4(1H)-QUINOLINONE,
946784-67-4,
6-Chloro-2-(chloromethyl)quinolin-4(1H)-one,
CTK5H6985,
DTXSID40589829,
ZINC8732761,
ZX-CM006019,
FCH933342,
MFCD11053911,
AKOS006338841,
AJ-59167,
Y-6510,
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| Complexity | 277 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.072g/mol |
| Monoisotopic Mass | 226.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number