1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid
TL;DR: 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid (CAS 16479-21-3) is a chemical compound with molecular formula C20H7Cl12NO5S and molecular weight 792.63074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4,5,6,7,16,17,18,19,19,20,20-dodecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene-11-sulfonic acid
Also Known As: 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid, 1,4,5,6,7,16,17,18,19,19,20,20-Dodecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene-11-sulfonic acid
Technical Specifications
| Molecular Formula | C20H7Cl12NO5S |
| Molecular Weight | 792.63074 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 792.63074 Da |
| Heavy Atoms | 39 |
| Complexity | 1410.0 |
| SMILES | C1=C2C3C(C4C(C2=CC(=C1[N+](=O)[O-])S(=O)(=O)O)C5(C(=C(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6(C(=C(C3(C6(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | BCPWEHMVDWTVEJ-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid
Property Insights of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid
The XLogP value of 6.4 indicates that 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid. Following Lipinski's Rule of Five, 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid?
The CAS number of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid is 16479-21-3.
What is the molecular formula of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid?
The molecular formula of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid is C20H7Cl12NO5S.
What is the molecular weight of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid?
The molecular weight of 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid is 792.63074 g/mol.
Where can I buy 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid?
You can request a quote for 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid?
Yes, CoreyChem provides custom synthesis services for 1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene-10-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.