RefChem:1084529
TL;DR: RefChem:1084529 (CAS 152270-98-9) is a chemical compound with molecular formula C40H62N2O12 and molecular weight 762.4303 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;bis(1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]ethanone)
Also Known As: Ethanone, 1-(4-(2-hydroxy-3-(propylamino)propoxy)-3-(propoxymethyl)phenyl)-, (E)-2-butenedioate (2:1) (salt), (E)-but-2-enedioic acid; 1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]ethanone, But-2-enedioic Acid; 1-[4-(2-hydroxy-3-propylamino-propoxy)-3-(propoxymethyl)phenyl]ethanone
Technical Specifications
| Molecular Formula | C40H62N2O12 |
| Molecular Weight | 762.4303 g/mol |
| XLogP | 4.822 |
| Topological Polar Surface Area (TPSA) | 210.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 26 |
| Exact Mass | 762.4303 Da |
| Heavy Atoms | 54 |
| Complexity | 443.0 |
| SMILES | CCCNCC(COC1=C(C=C(C=C1)C(=O)C)COCCC)O.CCCNCC(COC1=C(C=C(C=C1)C(=O)C)COCCC)O.C(=C/C(=O)O)\C(=O)O |
| InChIKey | VHEUZUDESDMICS-WXXKFALUSA-N |
Chemical Property Profile of RefChem:1084529
Property Insights of RefChem:1084529
The XLogP value of 4.822 indicates that RefChem:1084529 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 210.0 Ų indicates high polarity, suggesting RefChem:1084529 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1084529 has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1084529?
The CAS number of RefChem:1084529 is 152270-98-9.
What is the molecular formula of RefChem:1084529?
The molecular formula of RefChem:1084529 is C40H62N2O12.
What is the molecular weight of RefChem:1084529?
The molecular weight of RefChem:1084529 is 762.4303 g/mol.
Where can I buy RefChem:1084529?
You can request a quote for RefChem:1084529 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1084529?
Yes, CoreyChem provides custom synthesis services for RefChem:1084529 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.