C36H31NO9
TL;DR: C36H31NO9 (CAS 1212185-18-6) is a chemical compound with molecular formula C36H31NO9 and molecular weight 621.1999 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-O-benzyl 1-O-(2-methyl-4-oxo-3-phenoxychromen-7-yl) (2R)-2-(phenylmethoxycarbonylamino)pentanedioate
Also Known As: EiM07-16061, (R)-5-benzyl 1-(2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl) 2-(((benzyloxy)carbonyl)amino)pentanedioate
Technical Specifications
| Molecular Formula | C36H31NO9 |
| Molecular Weight | 621.1999 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 621.1999 Da |
| Heavy Atoms | 46 |
| Complexity | 1070.0 |
| SMILES | CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)[C@@H](CCC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)OC5=CC=CC=C5 |
| InChIKey | QISPEVSRJYHNSE-SSEXGKCCSA-N |
Chemical Property Profile of C36H31NO9
Property Insights of C36H31NO9
The XLogP value of 6.4 indicates that C36H31NO9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C36H31NO9. Following Lipinski's Rule of Five, C36H31NO9 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C36H31NO9?
The CAS number of C36H31NO9 is 1212185-18-6.
What is the molecular formula of C36H31NO9?
The molecular formula of C36H31NO9 is C36H31NO9.
What is the molecular weight of C36H31NO9?
The molecular weight of C36H31NO9 is 621.1999 g/mol.
Where can I buy C36H31NO9?
You can request a quote for C36H31NO9 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C36H31NO9?
Yes, CoreyChem provides custom synthesis services for C36H31NO9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.