9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid
TL;DR: 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid (CAS 7779-99-9) is a chemical compound with molecular formula C22H44O6S and molecular weight 436.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl octadec-9-enoate;sulfuric acid
Also Known As: ISOBUTYL OLEATE, SULFATED, Oleic acid, isobutyl ester, sulfate, Isobutyl oleate, compound with sulphuric acid, 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid, 9-Octadecenoic acid (Z)-, 2-methylpropyl ester, compd. with sulfuric acid
| Molecular Formula | C22H44O6S |
|---|---|
| Molecular Weight | 436.29 g/mol |
| LogP | 6.57 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 436.28586 |
| Heavy Atoms | 29 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 7779-99-9 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(C)C.OS(=O)(=O)O |
| InChIKey | XXLGTHUPNRRNRQ-UHFFFAOYSA-N |
Product Overview
9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid (CAS 7779-99-9), with molecular formula C22H44O6S and molecular weight 436.29 g/mol. IUPAC: 2-methylpropyl octadec-9-enoate;sulfuric acid.
Chemical Property Profile of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid
Property Insights of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid
The XLogP value of 6.57 indicates that 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid. Following Lipinski's Rule of Five, 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid has 2 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 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid?
The CAS number of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid is 7779-99-9.
What is the molecular formula of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid?
The molecular formula of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid is C22H44O6S.
What is the molecular weight of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid?
The molecular weight of 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid is 436.29 g/mol.
Where can I buy 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid?
You can request a quote for 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid 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 (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid?
Yes, KEHONG BIO provides custom synthesis services for 9-Octadecenoic acid (9Z)-, 2-methylpropyl ester, compd. with sulfuric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.