1,4-Butanediol, bis(dimethylphosphinate)
TL;DR: 1,4-Butanediol, bis(dimethylphosphinate) (CAS 5314-11-4) is a chemical compound with molecular formula C8H20O4P2 and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(dimethylphosphoryloxy)butane
Also Known As: 1,4-Butanediol, bis(dimethylphosphinate), 1,4-bis(dimethylphosphoryloxy)butane, KST-1A9372, Butane-1,4-diyl bis[dimethyl(phosphinate)], dimethyl-phosphinic acid, 1,4-butanediyl ester
| Molecular Formula | C8H20O4P2 |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 242.08368 |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 5314-11-4 |
|---|---|
| SMILES | CP(=O)(C)OCCCCOP(=O)(C)C |
| InChIKey | NPJUOKHNGXTQIQ-UHFFFAOYSA-N |
Product Overview
1,4-Butanediol, bis(dimethylphosphinate) (CAS 5314-11-4), with molecular formula C8H20O4P2 and molecular weight 242.08 g/mol. IUPAC: 1,4-bis(dimethylphosphoryloxy)butane.
Chemical Property Profile of 1,4-Butanediol, bis(dimethylphosphinate)
Property Insights of 1,4-Butanediol, bis(dimethylphosphinate)
The XLogP value of -0.7 indicates that 1,4-Butanediol, bis(dimethylphosphinate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-Butanediol, bis(dimethylphosphinate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Butanediol, bis(dimethylphosphinate) has 0 hydrogen bond donor(s) and 4 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 1,4-Butanediol, bis(dimethylphosphinate)?
The CAS number of 1,4-Butanediol, bis(dimethylphosphinate) is 5314-11-4.
What is the molecular formula of 1,4-Butanediol, bis(dimethylphosphinate)?
The molecular formula of 1,4-Butanediol, bis(dimethylphosphinate) is C8H20O4P2.
What is the molecular weight of 1,4-Butanediol, bis(dimethylphosphinate)?
The molecular weight of 1,4-Butanediol, bis(dimethylphosphinate) is 242.08 g/mol.
Where can I buy 1,4-Butanediol, bis(dimethylphosphinate)?
You can request a quote for 1,4-Butanediol, bis(dimethylphosphinate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Butanediol, bis(dimethylphosphinate)?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Butanediol, bis(dimethylphosphinate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.