9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol
TL;DR: 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol (CAS 58561-47-0) is a chemical compound with molecular formula C23H46O5 and molecular weight 402.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxypropyl 5-hydroxy-2-octyldodecanoate
Also Known As: EINECS 261-327-4, 2,3-dihydroxypropyl 5-hydroxy-2-octyldodecanoate, 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol, 9-Octadecenoic acid, 12-hydroxy-, [R-(Z)]-, ester with 1,2,3-propanetriol, 261-327-4
| Molecular Formula | C23H46O5 |
|---|---|
| Molecular Weight | 402.33 g/mol |
| LogP | 4.7512 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 402.33453 |
| Heavy Atoms | 28 |
| Complexity | 347.8844 |
Chemical Identifiers
| CAS Number | 58561-47-0 |
|---|---|
| SMILES | CCCCCCCCC(CCC(CCCCCCC)O)C(=O)OCC(CO)O |
Product Overview
9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol (CAS 58561-47-0), with molecular formula C23H46O5 and molecular weight 402.33 g/mol. IUPAC: 2,3-dihydroxypropyl 5-hydroxy-2-octyldodecanoate.
Chemical Property Profile of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol
Property Insights of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol
The XLogP value of 4.7512 indicates that 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol. Following Lipinski's Rule of Five, 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol has 3 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 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol?
The CAS number of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol is 58561-47-0.
What is the molecular formula of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol?
The molecular formula of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol is C23H46O5.
What is the molecular weight of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol?
The molecular weight of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol is 402.33 g/mol.
Where can I buy 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol?
You can request a quote for 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol?
Yes, KEHONG BIO provides custom synthesis services for 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.