丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷
TL;DR: 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 (CAS 113706-14-2) is a chemical compound with molecular formula C12H27O2PS2 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷
butan-2-yloxy-(6-methylheptoxy)-sulfanyl-sulfanylidene-λ5-phosphane
Also Known As: Phosphorodithioic acid, mixed O,O-bis(sec-Bu and isooctyl) esters, butan-2-yloxy-(6-methylheptoxy)-sulfanyl-sulfanylidene-
| Molecular Formula | C12H27O2PS2 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 298.11902 |
| Heavy Atoms | 17 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 113706-14-2 |
|---|---|
| SMILES | CCC(C)OP(=S)(OCCCCCC(C)C)S |
| InChIKey | LPEQNMKNSKSCGZ-UHFFFAOYSA-N |
Product Overview
丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 (CAS 113706-14-2), with molecular formula C12H27O2PS2 and molecular weight 298.12 g/mol. IUPAC: butan-2-yloxy-(6-methylheptoxy)-sulfanyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷
Property Insights of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷
The XLogP value of 6.1 indicates that 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 has 1 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 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷?
The CAS number of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 is 113706-14-2.
What is the molecular formula of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷?
The molecular formula of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 is C12H27O2PS2.
What is the molecular weight of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷?
The molecular weight of 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 is 298.12 g/mol.
Where can I buy 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷?
You can request a quote for 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷?
Yes, KEHONG BIO provides custom synthesis services for 丁-2-基氧-(6-甲基庚氧基)-硫代-硫代亚甲基-λ5-磷烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.