3-Perylenecarbonitrile
TL;DR: 3-Perylenecarbonitrile (CAS 35426-74-5) is a chemical compound with molecular formula C21H11N and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
perylene-3-carbonitrile
Also Known As: 3-Perylenecarbonitrile, Perylene-3-carbonitrile, 3-Cyanoperylene, 3-Cyanoperylen, J1.800.484D
| Molecular Formula | C21H11N |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 5.60888 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 277.08914 |
| Heavy Atoms | 22 |
| Complexity | 1174.9382 |
Chemical Identifiers
| CAS Number | 35426-74-5 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)C#N)C=CC=C5C3=CC=C2 |
Product Overview
3-Perylenecarbonitrile (CAS 35426-74-5), with molecular formula C21H11N and molecular weight 277.09 g/mol. IUPAC: perylene-3-carbonitrile.
Chemical Property Profile of 3-Perylenecarbonitrile
Property Insights of 3-Perylenecarbonitrile
The XLogP value of 5.60888 indicates that 3-Perylenecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 3-Perylenecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Perylenecarbonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Perylenecarbonitrile?
The CAS number of 3-Perylenecarbonitrile is 35426-74-5.
What is the molecular formula of 3-Perylenecarbonitrile?
The molecular formula of 3-Perylenecarbonitrile is C21H11N.
What is the molecular weight of 3-Perylenecarbonitrile?
The molecular weight of 3-Perylenecarbonitrile is 277.09 g/mol.
Where can I buy 3-Perylenecarbonitrile?
You can request a quote for 3-Perylenecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Perylenecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Perylenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.