RefChem:131207
TL;DR: RefChem:131207 (CAS 68130-29-0) is a chemical compound with molecular formula C40H82O16 and molecular weight 818.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decanoic acid;heptanoic acid;2-[[3-hydroxy-2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol;octanoic acid
Also Known As: Tripentaerythritol, heptanoic acid, caprylic acid, capric acid mixed esters, Decanoic acid, ester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediol heptanoate octanoate, Decanoic acid, ester with 2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-1,3-propanediol heptanoate octanoate, 268-583-6, decanoic acid; heptanoic acid; 2-[[3-hydroxy-2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; octanoic acid
| Molecular Formula | C40H82O16 |
|---|---|
| Molecular Weight | 818.56 g/mol |
| LogP | 3.6018 |
| Topological Polar Surface Area | 292.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 35 |
| Exact Mass | 818.5603 |
| Heavy Atoms | 56 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 68130-29-0 |
|---|---|
| SMILES | CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)COCC(CO)(CO)CO)O |
| InChIKey | OCAMSQKTTMYNNM-UHFFFAOYSA-N |
Product Overview
RefChem:131207 (CAS 68130-29-0), with molecular formula C40H82O16 and molecular weight 818.56 g/mol. IUPAC: decanoic acid;heptanoic acid;2-[[3-hydroxy-2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol;octanoic acid.
Chemical Property Profile of RefChem:131207
Property Insights of RefChem:131207
The XLogP value of 3.6018 indicates that RefChem:131207 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 292.0 Ų indicates high polarity, suggesting RefChem:131207 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:131207 has 11 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:131207?
The CAS number of RefChem:131207 is 68130-29-0.
What is the molecular formula of RefChem:131207?
The molecular formula of RefChem:131207 is C40H82O16.
What is the molecular weight of RefChem:131207?
The molecular weight of RefChem:131207 is 818.56 g/mol.
Where can I buy RefChem:131207?
You can request a quote for RefChem:131207 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:131207?
Yes, KEHONG BIO provides custom synthesis services for RefChem:131207 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.