Sodium 1-methoxy-4-prop-1-enylbenzene
TL;DR: Sodium 1-methoxy-4-prop-1-enylbenzene (CAS 52993-95-0) is a chemical compound with molecular formula C10H12NaO+ and molecular weight 171.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 1-methoxy-4-prop-1-enylbenzene
Also Known As: POLYANETHOLESULFONIC ACID SODIUM SALT, CID 6441684
| Molecular Formula | C10H12NaO+ |
|---|---|
| Molecular Weight | 171.08 g/mol |
| LogP | -0.2677 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.07858 |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 52993-95-0 |
|---|---|
| SMILES | CC=CC1=CC=C(C=C1)OC.[Na+] |
| InChIKey | CZGYTOCDSMDCRG-UHFFFAOYSA-N |
Product Overview
Sodium 1-methoxy-4-prop-1-enylbenzene (CAS 52993-95-0), with molecular formula C10H12NaO+ and molecular weight 171.08 g/mol. IUPAC: sodium 1-methoxy-4-prop-1-enylbenzene.
Chemical Property Profile of Sodium 1-methoxy-4-prop-1-enylbenzene
Property Insights of Sodium 1-methoxy-4-prop-1-enylbenzene
The XLogP value of -0.2677 indicates that Sodium 1-methoxy-4-prop-1-enylbenzene is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, Sodium 1-methoxy-4-prop-1-enylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium 1-methoxy-4-prop-1-enylbenzene has 0 hydrogen bond donor(s) and 1 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 Sodium 1-methoxy-4-prop-1-enylbenzene?
The CAS number of Sodium 1-methoxy-4-prop-1-enylbenzene is 52993-95-0.
What is the molecular formula of Sodium 1-methoxy-4-prop-1-enylbenzene?
The molecular formula of Sodium 1-methoxy-4-prop-1-enylbenzene is C10H12NaO+.
What is the molecular weight of Sodium 1-methoxy-4-prop-1-enylbenzene?
The molecular weight of Sodium 1-methoxy-4-prop-1-enylbenzene is 171.08 g/mol.
Where can I buy Sodium 1-methoxy-4-prop-1-enylbenzene?
You can request a quote for Sodium 1-methoxy-4-prop-1-enylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium 1-methoxy-4-prop-1-enylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Sodium 1-methoxy-4-prop-1-enylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.