4-O-(3-nitropropanoyl)corollin
TL;DR: 4-O-(3-nitropropanoyl)corollin (CAS 122475-42-7) is a chemical compound with molecular formula C18H24N4O18 and molecular weight 584.1086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-hydroxy-3,4,5-tris(3-nitropropanoyloxy)oxan-2-yl]methyl 3-nitropropanoate
Also Known As: 4-O-(3-nitropropanoyl)corollin, KBio2_006040, [6-hydroxy-3,4,5-tris(3-nitropropanoyloxy)oxan-2-yl]methyl 3-nitropropanoate, alpha-D-Glucopyranose 2,3,4,6-tetrakis(3-nitropropanoate), [(2R,3R,4S,5R,6S)-6-Hydroxy-3,4,5-tris(3-nitropropanoyloxy)oxan-2-yl]methyl 3-nitropropanoate
Technical Specifications
| Molecular Formula | C18H24N4O18 |
| Molecular Weight | 584.1086 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 318.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 17 |
| Exact Mass | 584.1086 Da |
| Heavy Atoms | 40 |
| Complexity | 966.0 |
| SMILES | C(C[N+](=O)[O-])C(=O)OCC1C(C(C(C(O1)O)OC(=O)CC[N+](=O)[O-])OC(=O)CC[N+](=O)[O-])OC(=O)CC[N+](=O)[O-] |
| InChIKey | JMPKPWBLQUWFHQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-O-(3-nitropropanoyl)corollin
Property Insights of 4-O-(3-nitropropanoyl)corollin
The XLogP value of -1.0 indicates that 4-O-(3-nitropropanoyl)corollin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 318.0 Ų indicates high polarity, suggesting 4-O-(3-nitropropanoyl)corollin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-O-(3-nitropropanoyl)corollin has 1 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-O-(3-nitropropanoyl)corollin?
The CAS number of 4-O-(3-nitropropanoyl)corollin is 122475-42-7.
What is the molecular formula of 4-O-(3-nitropropanoyl)corollin?
The molecular formula of 4-O-(3-nitropropanoyl)corollin is C18H24N4O18.
What is the molecular weight of 4-O-(3-nitropropanoyl)corollin?
The molecular weight of 4-O-(3-nitropropanoyl)corollin is 584.1086 g/mol.
Where can I buy 4-O-(3-nitropropanoyl)corollin?
You can request a quote for 4-O-(3-nitropropanoyl)corollin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-O-(3-nitropropanoyl)corollin?
Yes, CoreyChem provides custom synthesis services for 4-O-(3-nitropropanoyl)corollin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.