hexaphenylstannane
TL;DR: hexaphenylstannane (CAS 1064-20-6) is a chemical compound with molecular formula C21H6Cl12O4S and molecular weight 773.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,6,7,19,20,21,22,22,23,23-dodecachloro-12,12-dioxo-13-oxa-12λ6-thiaheptacyclo[17.2.1.14,7.02,18.03,8.09,17.011,15]tricosa-5,9,11(15),16,20-pentaen-14-one
Also Known As: hexaphenylstannane, 3-SULFO2NAPHTHOIC ACID, CYCLIC ANHYDRIDE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT, 1,2,3,4,5,6,7,8,14,14,15,15-Dodecachloro-1,4,4a,4b,5,8,8a,13b-octahydro-1,4:5,8-dimethano-10lambda~6~-triphenyleno[2,3-c][1,2]oxathiole-10,10,12-trione, 1,4,5,6,7,19,20,21,22,22,23,23-Dodecachloro-12,12-dioxo-13-oxa-12lambda6-thiaheptacyclo[17.2.1.14,7.02,18.03,8.09,17.011,15]tricosa-5,9,11(15),16,20-pentaen-14-one, RefChem:854873
| Molecular Formula | C21H6Cl12O4S |
|---|---|
| Molecular Weight | 773.62 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 773.62494 |
| Heavy Atoms | 38 |
| Complexity | 1420.0 |
Chemical Identifiers
| CAS Number | 1064-20-6 |
|---|---|
| SMILES | C1=C2C3C(C4C(C2=CC5=C1C(=O)OS5(=O)=O)C6(C(=C(C4(C6(Cl)Cl)Cl)Cl)Cl)Cl)C7(C(=C(C3(C7(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | BQRVEIVYDIPWIB-UHFFFAOYSA-N |
Product Overview
hexaphenylstannane (CAS 1064-20-6), with molecular formula C21H6Cl12O4S and molecular weight 773.62 g/mol. IUPAC: 1,4,5,6,7,19,20,21,22,22,23,23-dodecachloro-12,12-dioxo-13-oxa-12λ6-thiaheptacyclo[17.2.1.14,7.02,18.03,8.09,17.011,15]tricosa-5,9,11(15),16,20-pentaen-14-one.
Chemical Property Profile of hexaphenylstannane
Property Insights of hexaphenylstannane
The XLogP value of 6.9 indicates that hexaphenylstannane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for hexaphenylstannane. Following Lipinski's Rule of Five, hexaphenylstannane has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of hexaphenylstannane?
The CAS number of hexaphenylstannane is 1064-20-6.
What is the molecular formula of hexaphenylstannane?
The molecular formula of hexaphenylstannane is C21H6Cl12O4S.
What is the molecular weight of hexaphenylstannane?
The molecular weight of hexaphenylstannane is 773.62 g/mol.
Where can I buy hexaphenylstannane?
You can request a quote for hexaphenylstannane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexaphenylstannane?
Yes, KEHONG BIO provides custom synthesis services for hexaphenylstannane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.