Hydroxybutyl methyl cellulose
TL;DR: Hydroxybutyl methyl cellulose (CAS 9041-56-9) is a chemical compound with molecular formula C64H124O30 and molecular weight 1372.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R,6R)-2,3,4-trimethoxy-6-(methoxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane;1-[[(2R,3R,4S,5R,6S)-3,4,5-tris(2-hydroxybutoxy)-6-[(2R,3R,4S,5R,6R)-4,5,6-tris(2-hydroxybutoxy)-2-(2-hydroxybutoxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]butan-2-ol
Also Known As: Hydroxybutyl methyl cellulose, (2R,3R,4S,5R,6R)-2,3,4-trimethoxy-6-(methoxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane; 1-[[(2R,3R,4S,5R,6S)-3,4,5-tris(2-hydroxybutoxy)-6-[(2R,3R,4S,5R,6R)-4,5,6-tris(2-hydroxybutoxy)-2-(2-hydroxybutoxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]butan-2-ol
| Molecular Formula | C64H124O30 |
|---|---|
| Molecular Weight | 1372.82 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 364.9 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 48 |
| Exact Mass | 1372.8177 |
| Heavy Atoms | 94 |
| Complexity | 1843.1992 |
Chemical Identifiers
| CAS Number | 9041-56-9 |
|---|---|
| SMILES | CCC(COC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2OCC(CC)O)OCC(CC)O)OCC(CC)O)COCC(CC)O)OCC(CC)O)OCC(CC)O)OCC(CC)O)O.COC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2OC)OC)OC)COC)OC)OC)OC |
Product Overview
Hydroxybutyl methyl cellulose (CAS 9041-56-9), with molecular formula C64H124O30 and molecular weight 1372.82 g/mol. IUPAC: (2R,3R,4S,5R,6R)-2,3,4-trimethoxy-6-(methoxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane;1-[[(2R,3R,4S,5R,6S)-3,4,5-tris(2-hydroxybutoxy)-6-[(2R,3R,4S,5R,6R)-4,5,6-tris(2-hydroxybutoxy)-2-(2-hydroxybutoxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]butan-2-ol.
Chemical Property Profile of Hydroxybutyl methyl cellulose
Property Insights of Hydroxybutyl methyl cellulose
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxybutyl methyl cellulose. The TPSA of 364.9 Ų indicates high polarity, suggesting Hydroxybutyl methyl cellulose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hydroxybutyl methyl cellulose has 8 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydroxybutyl methyl cellulose?
The CAS number of Hydroxybutyl methyl cellulose is 9041-56-9.
What is the molecular formula of Hydroxybutyl methyl cellulose?
The molecular formula of Hydroxybutyl methyl cellulose is C64H124O30.
What is the molecular weight of Hydroxybutyl methyl cellulose?
The molecular weight of Hydroxybutyl methyl cellulose is 1372.82 g/mol.
Where can I buy Hydroxybutyl methyl cellulose?
You can request a quote for Hydroxybutyl methyl cellulose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxybutyl methyl cellulose?
Yes, KEHONG BIO provides custom synthesis services for Hydroxybutyl methyl cellulose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.