![1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene structure](/static/products/6467/64672-76-0.webp)
1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene
TL;DR: 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene (CAS 64672-76-0) is a chemical compound with molecular formula C29H7Cl15S4 and molecular weight 1007.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene
Also Known As: 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene, 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[, 1,1',1''-[{4-[(4-Methylphenyl)sulfanyl]but-1-en-3-yne-1,1,2-triyl}tris(sulfanediyl)]tris(2,3,4,5,6-pentachlorobenzene)
| Molecular Formula | C29H7Cl15S4 |
|---|---|
| Molecular Weight | 1007.48 g/mol |
| LogP | 19.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 1007.4758 |
| Heavy Atoms | 48 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 64672-76-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC#CC(=C(SC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)SC3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)Cl)SC4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)Cl |
| InChIKey | NFQXJYCCWUMWKC-UHFFFAOYSA-N |
Product Overview
1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene (CAS 64672-76-0), with molecular formula C29H7Cl15S4 and molecular weight 1007.48 g/mol. IUPAC: 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene.
Chemical Property Profile of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene
Property Insights of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene
The XLogP value of 19.4 indicates that 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene. Following Lipinski's Rule of Five, 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene 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 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene?
The CAS number of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene is 64672-76-0.
What is the molecular formula of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene?
The molecular formula of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene is C29H7Cl15S4.
What is the molecular weight of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene?
The molecular weight of 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene is 1007.48 g/mol.
Where can I buy 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene?
You can request a quote for 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,5-pentachloro-6-[4-(4-methylphenyl)sulfanyl-1,1-bis[(2,3,4,5,6-pentachlorophenyl)sulfanyl]but-1-en-3-yn-2-yl]sulfanylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.