Thianthrene, octachloro-
TL;DR: Thianthrene, octachloro- (CAS 7683-07-0) is a chemical compound with molecular formula C12Cl8S2 and molecular weight 487.69 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,6,7,8,9-octachlorothianthrene
Also Known As: Octachlorothianthrene, Thianthrene, octachloro-, Anthramycin 11-methyl ether, C12Cl8S2, 1,2,3,4,6,7,8,9-octachlorothianthrene
| Molecular Formula | C12Cl8S2 |
|---|---|
| Molecular Weight | 487.69 g/mol |
| LogP | 9.5296 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 487.69498 |
| Heavy Atoms | 22 |
| Complexity | 697.8418 |
Chemical Identifiers
| CAS Number | 7683-07-0 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)SC3=C(S2)C(=C(C(=C3Cl)Cl)Cl)Cl |
Product Overview
Thianthrene, octachloro- (CAS 7683-07-0), with molecular formula C12Cl8S2 and molecular weight 487.69 g/mol. IUPAC: 1,2,3,4,6,7,8,9-octachlorothianthrene.
Chemical Property Profile of Thianthrene, octachloro-
Property Insights of Thianthrene, octachloro-
The XLogP value of 9.5296 indicates that Thianthrene, octachloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Thianthrene, octachloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thianthrene, octachloro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thianthrene, octachloro-?
The CAS number of Thianthrene, octachloro- is 7683-07-0.
What is the molecular formula of Thianthrene, octachloro-?
The molecular formula of Thianthrene, octachloro- is C12Cl8S2.
What is the molecular weight of Thianthrene, octachloro-?
The molecular weight of Thianthrene, octachloro- is 487.69 g/mol.
Where can I buy Thianthrene, octachloro-?
You can request a quote for Thianthrene, octachloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thianthrene, octachloro-?
Yes, KEHONG BIO provides custom synthesis services for Thianthrene, octachloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.