RefChem:1064230
TL;DR: RefChem:1064230 (CAS 80762-85-2) is a chemical compound with molecular formula C26H45NO6 and molecular weight 467.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-(tert-butylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propan-2-ol
Also Known As: 1-(t-Butylamino)-3-((3,7,11-trimethyl-2,6,10-dodecatrienyl)oxy)-2-propanol maleate, 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((3,7,11-trimethyl-2,6,10-dodecatrienyl)oxy)-, (E,E)-, (Z)-2-butenedioate (1:1), Tertiobutylamino-3 (trimethyl-3,7,11 dodecatriene-2,6,10 yl-1)oxy-1 propanol-2 maleate, (E)-but-2-enedioic acid,1-(tert-butylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propan-2-ol, (E)-but-2-enedioic acid; 1-(tert-butylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propan-2-ol
| Molecular Formula | C26H45NO6 |
|---|---|
| Molecular Weight | 467.32 g/mol |
| LogP | 4.883 |
| Topological Polar Surface Area | 116.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 467.32468 |
| Heavy Atoms | 33 |
| Complexity | 663.3859 |
Chemical Identifiers
| CAS Number | 80762-85-2 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/COCC(CNC(C)(C)C)O)/C)/C)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1064230 (CAS 80762-85-2), with molecular formula C26H45NO6 and molecular weight 467.32 g/mol. IUPAC: (E)-but-2-enedioic acid;1-(tert-butylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propan-2-ol.
Chemical Property Profile of RefChem:1064230
Property Insights of RefChem:1064230
The XLogP value of 4.883 indicates that RefChem:1064230 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.09 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1064230. Following Lipinski's Rule of Five, RefChem:1064230 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1064230?
The CAS number of RefChem:1064230 is 80762-85-2.
What is the molecular formula of RefChem:1064230?
The molecular formula of RefChem:1064230 is C26H45NO6.
What is the molecular weight of RefChem:1064230?
The molecular weight of RefChem:1064230 is 467.32 g/mol.
Where can I buy RefChem:1064230?
You can request a quote for RefChem:1064230 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1064230?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1064230 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.