Bis(acetoxymethyl)cromoglycate
TL;DR: Bis(acetoxymethyl)cromoglycate (CAS 131619-07-3) is a chemical compound with molecular formula C29H24O15 and molecular weight 612.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetyloxymethyl 5-[3-[2-(acetyloxymethoxycarbonyl)-4-oxochromen-5-yl]oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylate
Also Known As: Bis(acetoxymethyl)cromoglycate, CG-AM, 1,3-bis((2'-(( -2-hydroxypropane, (2S,3S)-2,3-epoxy-5-methylhexan-1-ol, 1,3-Bis((2'-(((acetoxymethyl)oxy)carbonyl)chromon-5'-yl)oxy)-2-hydroxypropane
| Molecular Formula | C29H24O15 |
|---|---|
| Molecular Weight | 612.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 16 |
| Exact Mass | 612.1115 |
| Heavy Atoms | 44 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 131619-07-3 |
|---|---|
| SMILES | CC(=O)OCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OCOC(=O)C)O |
| InChIKey | RIEJXTNOHSBUQV-UHFFFAOYSA-N |
Product Overview
Bis(acetoxymethyl)cromoglycate (CAS 131619-07-3), with molecular formula C29H24O15 and molecular weight 612.11 g/mol. IUPAC: acetyloxymethyl 5-[3-[2-(acetyloxymethoxycarbonyl)-4-oxochromen-5-yl]oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylate.
Chemical Property Profile of Bis(acetoxymethyl)cromoglycate
Property Insights of Bis(acetoxymethyl)cromoglycate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(acetoxymethyl)cromoglycate. The TPSA of 196.0 Ų indicates high polarity, suggesting Bis(acetoxymethyl)cromoglycate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis(acetoxymethyl)cromoglycate has 1 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(acetoxymethyl)cromoglycate?
The CAS number of Bis(acetoxymethyl)cromoglycate is 131619-07-3.
What is the molecular formula of Bis(acetoxymethyl)cromoglycate?
The molecular formula of Bis(acetoxymethyl)cromoglycate is C29H24O15.
What is the molecular weight of Bis(acetoxymethyl)cromoglycate?
The molecular weight of Bis(acetoxymethyl)cromoglycate is 612.11 g/mol.
Where can I buy Bis(acetoxymethyl)cromoglycate?
You can request a quote for Bis(acetoxymethyl)cromoglycate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(acetoxymethyl)cromoglycate?
Yes, KEHONG BIO provides custom synthesis services for Bis(acetoxymethyl)cromoglycate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.