Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate
TL;DR: Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate (CAS 37294-49-8) is a chemical compound with molecular formula C14H24Na2O7S and molecular weight 382.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-(8-methylnonoxy)-4-oxo-3-sulfonatobutanoate
Also Known As: EINECS 265-669-5, Disodium 1-isodecyl 2-sulphonatosuccinate, disodium1-isodecyl2-sulphonatosuccinate, disodium 4-(8-methylnonoxy)-4-oxo-3-sulfonatobutanoate, Butanedioic acid,sulfo-, 1-isodecyl ester, disodium salt (9CI)
| Molecular Formula | C14H24Na2O7S |
|---|---|
| Molecular Weight | 382.10 g/mol |
| LogP | -5.412 |
| Topological Polar Surface Area | 123.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 382.10382 |
| Heavy Atoms | 24 |
| Complexity | 452.0393 |
Chemical Identifiers
| CAS Number | 37294-49-8 |
|---|---|
| SMILES | CC(C)CCCCCCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
Product Overview
Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate (CAS 37294-49-8), with molecular formula C14H24Na2O7S and molecular weight 382.10 g/mol. IUPAC: disodium;4-(8-methylnonoxy)-4-oxo-3-sulfonatobutanoate.
Chemical Property Profile of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate
Property Insights of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate
The XLogP value of -5.412 indicates that Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate. Following Lipinski's Rule of Five, Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate has 0 hydrogen bond donor(s) and 7 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 Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate?
The CAS number of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate is 37294-49-8.
What is the molecular formula of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate?
The molecular formula of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate is C14H24Na2O7S.
What is the molecular weight of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate?
The molecular weight of Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate is 382.10 g/mol.
Where can I buy Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate?
You can request a quote for Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Disodium 4-[(8-methylnonyl)oxy]-4-oxo-3-sulfonatobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.