RefChem:1056937
TL;DR: RefChem:1056937 (CAS 106909-63-1) is a chemical compound with molecular formula C50H82N2O12 and molecular weight 902.5868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;bis(1-[3-(heptoxymethyl)-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one)
Also Known As: 1-(Heptyloxymethyl)-4-((2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanone maleate (2:1), 1-Propanone, 1-(3-((heptyloxy)methyl)-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, (E)-2-butenedioate (2:1) (salt), (E)-but-2-enedioic acid; 1-[3-(heptoxymethyl)-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one
Technical Specifications
| Molecular Formula | C50H82N2O12 |
| Molecular Weight | 902.5868 g/mol |
| XLogP | 8.7198 |
| Topological Polar Surface Area (TPSA) | 210.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 34 |
| Exact Mass | 902.5868 Da |
| Heavy Atoms | 64 |
| Complexity | 521.0 |
| SMILES | CCCCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.CCCCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.C(=C/C(=O)O)\C(=O)O |
| InChIKey | IMMYQTWWOPRFRP-WXXKFALUSA-N |
Product Description
Applications: RefChem:1056937 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, RefChem:1056937 (CAS 106909-63-1) has the molecular formula C50H82N2O12 and a molecular weight of 902.59 g/mol. Synonyms include 1-(Heptyloxymethyl)-4-((2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanone maleate (2:1) and 1-Propanone, 1-(3-((heptyloxy)methyl)-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, (E)-2-butenedioate (2:1) (salt).
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of RefChem:1056937
Property Insights of RefChem:1056937
The XLogP value of 8.7198 indicates that RefChem:1056937 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 210.0 Ų indicates high polarity, suggesting RefChem:1056937 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1056937 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:1056937?
The CAS number of RefChem:1056937 is 106909-63-1.
What is the molecular formula of RefChem:1056937?
The molecular formula of RefChem:1056937 is C50H82N2O12.
What is the molecular weight of RefChem:1056937?
The molecular weight of RefChem:1056937 is 902.5868 g/mol.
What are the applications of RefChem:1056937?
RefChem:1056937 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy RefChem:1056937?
You can request a quote for RefChem:1056937 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1056937?
Yes, CoreyChem provides custom synthesis services for RefChem:1056937 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.