3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile
TL;DR: 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile (CAS 56069-67-1) is a chemical compound with molecular formula C15H17NO4 and molecular weight 275.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,4,4-tetramethoxy-2-phenylcyclobutene-1-carbonitrile
Also Known As: 3,3,4,4-tetramethoxy-2-phenylcyclobutene-1-carbonitrile, 3,3,4,4-tetramethoxy-2-phenyl-cyclobutene-1-carbonitrile, 3,3,4,4-Tetramethoxy-2-phenylcyclobut-1-ene-1-carbonitrile
| Molecular Formula | C15H17NO4 |
|---|---|
| Molecular Weight | 275.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.11575 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 56069-67-1 |
|---|---|
| SMILES | COC1(C(=C(C1(OC)OC)C2=CC=CC=C2)C#N)OC |
| InChIKey | KZTAASCXLYJWEM-UHFFFAOYSA-N |
Product Overview
3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile (CAS 56069-67-1), with molecular formula C15H17NO4 and molecular weight 275.12 g/mol. IUPAC: 3,3,4,4-tetramethoxy-2-phenylcyclobutene-1-carbonitrile.
Chemical Property Profile of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile
Property Insights of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile. Following Lipinski's Rule of Five, 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile has 0 hydrogen bond donor(s) and 5 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 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile?
The CAS number of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile is 56069-67-1.
What is the molecular formula of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile?
The molecular formula of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile is C15H17NO4.
What is the molecular weight of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile?
The molecular weight of 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile is 275.12 g/mol.
Where can I buy 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile?
You can request a quote for 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3,4,4-Tetramethoxy-2-phenylcyclobutene-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.