Butanedioic acid, (decylthio)-
TL;DR: Butanedioic acid, (decylthio)- (CAS 60745-27-9) is a chemical compound with molecular formula C14H26O4S and molecular weight 290.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-decylsulfanylbutanedioic acid
Also Known As: Butanedioic acid, (decylthio)-, 2-decylsulfanylbutanedioic Acid, 2-(Decylthio)succinic acid, S-Decylmercaptobernsteinsaeure, C10H21SCH(COOH)CH2COOH
| Molecular Formula | C14H26O4S |
|---|---|
| Molecular Weight | 290.16 g/mol |
| LogP | 3.7882 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 290.15518 |
| Heavy Atoms | 19 |
| Complexity | 255.83052 |
Chemical Identifiers
| CAS Number | 60745-27-9 |
|---|---|
| SMILES | CCCCCCCCCCSC(CC(=O)O)C(=O)O |
Product Overview
Butanedioic acid, (decylthio)- (CAS 60745-27-9), with molecular formula C14H26O4S and molecular weight 290.16 g/mol. IUPAC: 2-decylsulfanylbutanedioic acid.
Chemical Property Profile of Butanedioic acid, (decylthio)-
Property Insights of Butanedioic acid, (decylthio)-
The XLogP value of 3.7882 indicates that Butanedioic acid, (decylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid, (decylthio)-. Following Lipinski's Rule of Five, Butanedioic acid, (decylthio)- has 2 hydrogen bond donor(s) and 3 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 Butanedioic acid, (decylthio)-?
The CAS number of Butanedioic acid, (decylthio)- is 60745-27-9.
What is the molecular formula of Butanedioic acid, (decylthio)-?
The molecular formula of Butanedioic acid, (decylthio)- is C14H26O4S.
What is the molecular weight of Butanedioic acid, (decylthio)-?
The molecular weight of Butanedioic acid, (decylthio)- is 290.16 g/mol.
Where can I buy Butanedioic acid, (decylthio)-?
You can request a quote for Butanedioic acid, (decylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, (decylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, (decylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.