(4-Cyanophenyl) phenyl carbonate
TL;DR: (4-Cyanophenyl) phenyl carbonate (CAS 17175-15-4) is a chemical compound with molecular formula C14H9NO3 and molecular weight 239.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyanophenyl) phenyl carbonate
Also Known As: 4-Cyanophenyl phenyl carbonate, (4-cyanophenyl) phenyl carbonate, 4-Cyanophenyl phenyl carbonate #, Carbonic acid O-phenyl O-(4-cyanophenyl) ester, Carbonic acid (4-cyanophenyl)phenyl ester
| Molecular Formula | C14H9NO3 |
|---|---|
| Molecular Weight | 239.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.05824 |
| Heavy Atoms | 18 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 17175-15-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)OC2=CC=C(C=C2)C#N |
| InChIKey | NDAZHUOVVOFBHT-UHFFFAOYSA-N |
Product Overview
(4-Cyanophenyl) phenyl carbonate (CAS 17175-15-4), with molecular formula C14H9NO3 and molecular weight 239.06 g/mol. IUPAC: (4-cyanophenyl) phenyl carbonate.
Chemical Property Profile of (4-Cyanophenyl) phenyl carbonate
Property Insights of (4-Cyanophenyl) phenyl carbonate
The XLogP value of 3.0 indicates that (4-Cyanophenyl) phenyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, (4-Cyanophenyl) phenyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Cyanophenyl) phenyl carbonate 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 (4-Cyanophenyl) phenyl carbonate?
The CAS number of (4-Cyanophenyl) phenyl carbonate is 17175-15-4.
What is the molecular formula of (4-Cyanophenyl) phenyl carbonate?
The molecular formula of (4-Cyanophenyl) phenyl carbonate is C14H9NO3.
What is the molecular weight of (4-Cyanophenyl) phenyl carbonate?
The molecular weight of (4-Cyanophenyl) phenyl carbonate is 239.06 g/mol.
Where can I buy (4-Cyanophenyl) phenyl carbonate?
You can request a quote for (4-Cyanophenyl) phenyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Cyanophenyl) phenyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for (4-Cyanophenyl) phenyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.