| CAS Number | 859745-06-5 |
| Catalog Number | AG01FNJ6(AGN-PC-3H4BG4) |
| Chemical Name | 7-chlorodibenzo[c,h]acridine |
| IUPAC Name | 13-chloro-2-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4,6,8,10,13,15,17,19,21-undecaene |
| InChI | InChI=1S/C21H12ClN/c22-19-17-11-9-13-5-1-3-7-15(13)20(17)23-21-16-8-4-2-6-14(16)10-12-18(19)21/h1-12H |
| InChI Key | KXAUQHJDRHPCPU-UHFFFAOYSA-N |
| MDL Number | MFCD32068124 |
| Molecular Formula | C21H12ClN |
| Molecular Weight | 313.7797 |
| SMILES | ClC1=C2C=CC3=C(C2=NC=2C4=C(C=CC12)C=CC=C4)C=CC=C3 |
| Synonyms | 859745-06-5,
7-chlorodibenzo[c,h]acridine,
7-Chloro-dibenz[c,h]acridine,
SCHEMBL18650741,
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| Complexity | 400 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 313.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 313.784g/mol |
| Monoisotopic Mass | 313.066g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6.7 |
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Certificate of Analysis
Lot Number