4,4'-Dithiobisphenylbutyric Acid
TL;DR: 4,4'-Dithiobisphenylbutyric Acid (CAS 72007-92-2) is a chemical compound with molecular formula C20H22O4S2 and molecular weight 390.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[[4-(3-carboxypropyl)phenyl]disulfanyl]phenyl]butanoic acid
Also Known As: 4,4'-Dithiobisphenylbutyric Acid, 4,4'-Dithiobisphenylbutyric Acid, 4-[4-[[4-(3-carboxypropyl)phenyl]disulfanyl]phenyl]butanoic acid, 4,4'-[Disulfanediyldi(4,1-phenylene)]dibutanoic acid, 4-[4-[4-(3-carboxypropyl)phenyl]disulfanylphenyl]butanoic Acid
| Molecular Formula | C20H22O4S2 |
|---|---|
| Molecular Weight | 390.10 g/mol |
| LogP | 5.3006 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 390.09595 |
| Heavy Atoms | 26 |
| Complexity | 648.09595 |
Chemical Identifiers
| CAS Number | 72007-92-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCC(=O)O)SSC2=CC=C(C=C2)CCCC(=O)O |
Product Overview
4,4'-Dithiobisphenylbutyric Acid (CAS 72007-92-2), with molecular formula C20H22O4S2 and molecular weight 390.10 g/mol. IUPAC: 4-[4-[[4-(3-carboxypropyl)phenyl]disulfanyl]phenyl]butanoic acid.
Chemical Property Profile of 4,4'-Dithiobisphenylbutyric Acid
Property Insights of 4,4'-Dithiobisphenylbutyric Acid
The XLogP value of 5.3006 indicates that 4,4'-Dithiobisphenylbutyric Acid 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 4,4'-Dithiobisphenylbutyric Acid. Following Lipinski's Rule of Five, 4,4'-Dithiobisphenylbutyric Acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dithiobisphenylbutyric Acid?
The CAS number of 4,4'-Dithiobisphenylbutyric Acid is 72007-92-2.
What is the molecular formula of 4,4'-Dithiobisphenylbutyric Acid?
The molecular formula of 4,4'-Dithiobisphenylbutyric Acid is C20H22O4S2.
What is the molecular weight of 4,4'-Dithiobisphenylbutyric Acid?
The molecular weight of 4,4'-Dithiobisphenylbutyric Acid is 390.10 g/mol.
Where can I buy 4,4'-Dithiobisphenylbutyric Acid?
You can request a quote for 4,4'-Dithiobisphenylbutyric Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dithiobisphenylbutyric Acid?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dithiobisphenylbutyric Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.