1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)
TL;DR: 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) (CAS 29953-09-1) is a chemical compound with molecular formula C21H28O4S2 and molecular weight 408.1429 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-[2-[4-(2-hydroxy-3-sulfanylpropoxy)phenyl]propan-2-yl]phenoxy]-3-sulfanylpropan-2-ol
Also Known As: KST-1B2920, 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol), 1,1'-[isopropylidenebis]bis[3-mercaptopropan-2-ol], 1,1'-[isopropylidenebis ]bis[3-mercaptopropan-2-ol], bis(2-hydroxy-3-mercaptopropyl) ether of bisphenol A
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H28O4S2 |
| Molecular Weight | 408.1429 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 60.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 408.1429 Da |
| Heavy Atoms | 27 |
| Complexity | 369.0 |
| SMILES | CC(C)(C1=CC=C(C=C1)OCC(CS)O)C2=CC=C(C=C2)OCC(CS)O |
| InChIKey | OLPTYESEXWLOCS-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)
Property Insights of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)
The XLogP value of 4.0 indicates that 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol). Following Lipinski's Rule of Five, 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)?
The CAS number of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) is 29953-09-1.
What is the molecular formula of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)?
The molecular formula of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) is C21H28O4S2.
What is the molecular weight of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)?
The molecular weight of 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) is 408.1429 g/mol.
Where can I buy 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)?
You can request a quote for 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)?
Yes, CoreyChem provides custom synthesis services for 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.