RefChem:331229
TL;DR: RefChem:331229 (CAS 100700-32-1) is a chemical compound with molecular formula C23H34ClNO8 and molecular weight 487.1973 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-morpholin-4-ium-4-ylethyl 2-[(9-methoxy-7-methyl-5-oxo-3a,4,4a,8a,9,9a-hexahydrofuro[3,2-g]chromen-4-yl)oxy]butanoate chloride
Also Known As: Butyric acid, 2-((9-methoxy-7-methyl-5-oxo-3a,4,4a,8a,9,9a-hexahydro-5H-furo(3,2-g)(1)benzopyran-4-yl)oxy)-, 2-morpholinoethyl ester, hydrochloride, 2-Morpholin-4-ium-4-ylethyl2-[(9-methoxy-7-methyl-5-oxo-3a,4,4a,8a,9,9a-hexahydrofuro[3,2-g]chromen-4-yl)oxy]butanoate chloride, 2-morpholin-4-ium-4-ylethyl 2-[(9-methoxy-7-methyl-5-oxo-3a,4,4a,8a,9,9a-hexahydrofuro[3,2-g]chromen-4-yl)oxy]butanoate chloride, 2-morpholin-4-ium-4-ylethyl2-[(9-methoxy-7-methyl-5-oxo-3a,4,4a,8a,9,9a-hexahydrofuro[3,2-g]chromen-4-yl)oxy]butanoate, 4-[2-({2-[(9-methoxy-7-methyl-5-oxo-3a,4a,5,8a,9,9a-hexahydro-4h-furo[3,2-g]chromen-4-yl)oxy]butanoyl}oxy)ethyl]morpholin-4-ium chloride
Technical Specifications
| Molecular Formula | C23H34ClNO8 |
| Molecular Weight | 487.1973 g/mol |
| XLogP | -3.34 |
| Topological Polar Surface Area (TPSA) | 94.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.1973 Da |
| Heavy Atoms | 33 |
| Complexity | 746.0 |
| SMILES | CCC(C(=O)OCC[NH+]1CCOCC1)OC2C3C=COC3C(C4C2C(=O)C=C(O4)C)OC.[Cl-] |
| InChIKey | KSSNXEOMCXIDHS-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:331229
Property Insights of RefChem:331229
The XLogP value of -3.34 indicates that RefChem:331229 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:331229. Following Lipinski's Rule of Five, RefChem:331229 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:331229?
The CAS number of RefChem:331229 is 100700-32-1.
What is the molecular formula of RefChem:331229?
The molecular formula of RefChem:331229 is C23H34ClNO8.
What is the molecular weight of RefChem:331229?
The molecular weight of RefChem:331229 is 487.1973 g/mol.
Where can I buy RefChem:331229?
You can request a quote for RefChem:331229 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:331229?
Yes, CoreyChem provides custom synthesis services for RefChem:331229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.