RefChem:855542
TL;DR: RefChem:855542 (CAS 20103-35-9) is a chemical compound with molecular formula C40H77NO4 and molecular weight 635.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-heptadecyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl octadecanoate
Also Known As: [2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)oxazol-4-yl]methyl stearate|(2-Heptadecyl-4,5-dihydro-4-(hydroxymethyl)oxazol-4-yl)methyl stearate|(2-Heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl)methyl stearate|Stearic acid, (2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl)methyl ester|Octadecanoic acid, (2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl)methyl ester|Octadecanoic acid, [2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl]methyl ester|[2-heptadecyl-4-(hydroxymethyl)-4,5-dihydro-1,3-oxazol-4-yl]methyl octadecanoate|[2-Heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl]methyl stearate|[2-heptadecyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl octadecanoate|Octadecanoic acid [[2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)-oxazol]-4-yl]methyl ester|Octadecanoic acid,[2-heptadecyl-4,5-dihydro-4-(hydroxymethyl)-4-oxazolyl]methyl ester|EINECS 243-516-3|RefChem:855542|DTXCID901024515|DWWUGXOZBYVGJN-UHFFFAOYSA-N
| Molecular Formula | C40H77NO4 |
|---|---|
| Molecular Weight | 635.59 g/mol |
| LogP | 15.7 |
| Topological Polar Surface Area | 68.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 36 |
| Exact Mass | 635.58527 |
| Heavy Atoms | 45 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 20103-35-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NC(CO1)(CO)COC(=O)CCCCCCCCCCCCCCCCC |
| InChIKey | DWWUGXOZBYVGJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:855542 (CAS 20103-35-9), with molecular formula C40H77NO4 and molecular weight 635.59 g/mol. IUPAC: [2-heptadecyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl octadecanoate.
Chemical Property Profile of RefChem:855542
Property Insights of RefChem:855542
The XLogP value of 15.7 indicates that RefChem:855542 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:855542. Following Lipinski's Rule of Five, RefChem:855542 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:855542?
The CAS number of RefChem:855542 is 20103-35-9.
What is the molecular formula of RefChem:855542?
The molecular formula of RefChem:855542 is C40H77NO4.
What is the molecular weight of RefChem:855542?
The molecular weight of RefChem:855542 is 635.59 g/mol.
Where can I buy RefChem:855542?
You can request a quote for RefChem:855542 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:855542?
Yes, KEHONG BIO provides custom synthesis services for RefChem:855542 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.