Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate
TL;DR: Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate (CAS 55840-14-7) is a chemical compound with molecular formula C25H48O8 and molecular weight 476.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butanedioic acid;2,3-dihydroxypropyl octadecanoate
Also Known As: EINECS 259-856-0, Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate, butanedioic acid; 2,3-dihydroxypropyl octadecanoate, Butanedioic acid--2,3-dihydroxypropyl octadecanoate (1/1)
| Molecular Formula | C25H48O8 |
|---|---|
| Molecular Weight | 476.33 g/mol |
| LogP | 5.0801 |
| Topological Polar Surface Area | 141.36 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 476.33493 |
| Heavy Atoms | 33 |
| Complexity | 453.32327 |
Chemical Identifiers
| CAS Number | 55840-14-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O.C(CC(=O)O)C(=O)O |
Product Overview
Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate (CAS 55840-14-7), with molecular formula C25H48O8 and molecular weight 476.33 g/mol. IUPAC: butanedioic acid;2,3-dihydroxypropyl octadecanoate.
Chemical Property Profile of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate
Property Insights of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate
The XLogP value of 5.0801 indicates that Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.36 Ų indicates high polarity, suggesting Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate?
The CAS number of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate is 55840-14-7.
What is the molecular formula of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate?
The molecular formula of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate is C25H48O8.
What is the molecular weight of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate?
The molecular weight of Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate is 476.33 g/mol.
Where can I buy Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate?
You can request a quote for Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, ester with 1,2,3-propanetriol monooctadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.