Benzo(k)fluoranthene-7,12-dicarbonitrile
TL;DR: Benzo(k)fluoranthene-7,12-dicarbonitrile (CAS 72851-41-3) is a chemical compound with molecular formula C22H10N2 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[k]fluoranthene-7,12-dicarbonitrile
Also Known As: benzo[k]fluoranthene-7,12-dicarbonitrile, starbld0001949, 7,12-DICYANOBENZO[K]FLUORANTHENE, Benzo(k)fluoranthene-7,12-dicarbonitrile, 879-022-5
| Molecular Formula | C22H10N2 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 5.38376 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 302.0844 |
| Heavy Atoms | 24 |
| Complexity | 1172.1116 |
Chemical Identifiers
| CAS Number | 72851-41-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C4=CC=CC5=C4C(=CC=C5)C3=C2C#N)C#N |
Product Overview
Benzo(k)fluoranthene-7,12-dicarbonitrile (CAS 72851-41-3), with molecular formula C22H10N2 and molecular weight 302.08 g/mol. IUPAC: benzo[k]fluoranthene-7,12-dicarbonitrile.
Chemical Property Profile of Benzo(k)fluoranthene-7,12-dicarbonitrile
Property Insights of Benzo(k)fluoranthene-7,12-dicarbonitrile
The XLogP value of 5.38376 indicates that Benzo(k)fluoranthene-7,12-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.58 Ų, Benzo(k)fluoranthene-7,12-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(k)fluoranthene-7,12-dicarbonitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(k)fluoranthene-7,12-dicarbonitrile?
The CAS number of Benzo(k)fluoranthene-7,12-dicarbonitrile is 72851-41-3.
What is the molecular formula of Benzo(k)fluoranthene-7,12-dicarbonitrile?
The molecular formula of Benzo(k)fluoranthene-7,12-dicarbonitrile is C22H10N2.
What is the molecular weight of Benzo(k)fluoranthene-7,12-dicarbonitrile?
The molecular weight of Benzo(k)fluoranthene-7,12-dicarbonitrile is 302.08 g/mol.
Where can I buy Benzo(k)fluoranthene-7,12-dicarbonitrile?
You can request a quote for Benzo(k)fluoranthene-7,12-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(k)fluoranthene-7,12-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for Benzo(k)fluoranthene-7,12-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.