Benzanthronyl
TL;DR: Benzanthronyl (CAS 116-90-5) is a chemical compound with molecular formula C34H18O2 and molecular weight 458.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one
Also Known As: Dibenzonyl, Benzanthronyl, 4,4'-Dibenzanthronyl, 4,4'-Dibenzanthronil, 4,4'-bibenzanthrone
| Molecular Formula | C34H18O2 |
|---|---|
| Molecular Weight | 458.13 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 458.13068 |
| Heavy Atoms | 36 |
| Complexity | 820.0 |
Chemical Identifiers
| CAS Number | 116-90-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC4=C(C=CC(=C43)C2=O)C5=C6C=CC=C7C6=C(C=C5)C(=O)C8=CC=CC=C87 |
| InChIKey | FEQOTXWZPMPKGW-UHFFFAOYSA-N |
Product Overview
Benzanthronyl (CAS 116-90-5), with molecular formula C34H18O2 and molecular weight 458.13 g/mol. IUPAC: 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one.
Chemical Property Profile of Benzanthronyl
Property Insights of Benzanthronyl
The XLogP value of 8.3 indicates that Benzanthronyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Benzanthronyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzanthronyl 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 Benzanthronyl?
The CAS number of Benzanthronyl is 116-90-5.
What is the molecular formula of Benzanthronyl?
The molecular formula of Benzanthronyl is C34H18O2.
What is the molecular weight of Benzanthronyl?
The molecular weight of Benzanthronyl is 458.13 g/mol.
Where can I buy Benzanthronyl?
You can request a quote for Benzanthronyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzanthronyl?
Yes, KEHONG BIO provides custom synthesis services for Benzanthronyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.