diethyleneglycol dimethylether
TL;DR: diethyleneglycol dimethylether (CAS 111317-77-2) is a chemical compound with molecular formula C30H42O8 and molecular weight 530.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonyl-2-ethylpentanoic acid
Also Known As: diethyleneglycol dimethylether, 3-[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonyl-2-ethylpentanoic acid, 3-((2-((6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,1, 3-((2-((6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxoethoxy)carbonyl)-2-ethylpentanoic acid, 3-({[(6
| Molecular Formula | C30H42O8 |
|---|---|
| Molecular Weight | 530.29 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 530.28796 |
| Heavy Atoms | 38 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 111317-77-2 |
|---|---|
| SMILES | CCC(C(CC)C(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2C[C@@H](C4=CC(=O)C=C[C@]34C)C)O)C)O)C(=O)O |
| InChIKey | PUDQFKIKBYEBIB-QQOHLXGCSA-N |
Product Overview
diethyleneglycol dimethylether (CAS 111317-77-2), with molecular formula C30H42O8 and molecular weight 530.29 g/mol. IUPAC: 3-[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonyl-2-ethylpentanoic acid.
Chemical Property Profile of diethyleneglycol dimethylether
Property Insights of diethyleneglycol dimethylether
The XLogP value of 4.0 indicates that diethyleneglycol dimethylether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyleneglycol dimethylether. Following Lipinski's Rule of Five, diethyleneglycol dimethylether has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of diethyleneglycol dimethylether?
The CAS number of diethyleneglycol dimethylether is 111317-77-2.
What is the molecular formula of diethyleneglycol dimethylether?
The molecular formula of diethyleneglycol dimethylether is C30H42O8.
What is the molecular weight of diethyleneglycol dimethylether?
The molecular weight of diethyleneglycol dimethylether is 530.29 g/mol.
Where can I buy diethyleneglycol dimethylether?
You can request a quote for diethyleneglycol dimethylether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyleneglycol dimethylether?
Yes, KEHONG BIO provides custom synthesis services for diethyleneglycol dimethylether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.