6-氯汞胆固醇
TL;DR: 6-氯汞胆固醇 (CAS 84981-49-7) is a chemical compound with molecular formula C27H45ClHgO and molecular weight 622.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-氯汞胆固醇
chloro-[(3S,10R,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]mercury
Also Known As: 6-Chloromercuricholesterol, 6-Hgcl-cholesterol, 6-Chloromercuricholest-5-en-3beta-ol, U-617, 6-chloromercuricholest-5-en-3 beta-ol
| Molecular Formula | C27H45ClHgO |
|---|---|
| Molecular Weight | 622.29 g/mol |
| LogP | 7.9527 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 622.28656 |
| Heavy Atoms | 30 |
| Complexity | 659.0 |
Chemical Identifiers
| CAS Number | 84981-49-7 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2CC(=C4[C@@]3(CC[C@@H](C4)O)C)[Hg]Cl)C |
| InChIKey | YUDIFUJJWICWMY-VORNFGKDSA-M |
Product Overview
6-氯汞胆固醇 (CAS 84981-49-7), with molecular formula C27H45ClHgO and molecular weight 622.29 g/mol. IUPAC: chloro-[(3S,10R,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]mercury.
Chemical Property Profile of 6-氯汞胆固醇
Property Insights of 6-氯汞胆固醇
The XLogP value of 7.9527 indicates that 6-氯汞胆固醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 6-氯汞胆固醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-氯汞胆固醇 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-氯汞胆固醇?
The CAS number of 6-氯汞胆固醇 is 84981-49-7.
What is the molecular formula of 6-氯汞胆固醇?
The molecular formula of 6-氯汞胆固醇 is C27H45ClHgO.
What is the molecular weight of 6-氯汞胆固醇?
The molecular weight of 6-氯汞胆固醇 is 622.29 g/mol.
Where can I buy 6-氯汞胆固醇?
You can request a quote for 6-氯汞胆固醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-氯汞胆固醇?
Yes, KEHONG BIO provides custom synthesis services for 6-氯汞胆固醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.