Dibenz(a,j)anthracene, 3-methoxy-
TL;DR: Dibenz(a,j)anthracene, 3-methoxy- (CAS 83136-28-1) is a chemical compound with molecular formula C23H16O and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxypentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,7,10,13,15,17,19,21-undecaene
Also Known As: Dibenz(a,j)anthracene, 3-methoxy-, 3-methoxybenzo[m]tetraphene, RefChem:336977
| Molecular Formula | C23H16O |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.12012 |
| Heavy Atoms | 24 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 83136-28-1 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C(C=C2)C=C4C=CC5=CC=CC=C5C4=C3 |
| InChIKey | NLGUPUWPVBAGDJ-UHFFFAOYSA-N |
Product Overview
Dibenz(a,j)anthracene, 3-methoxy- (CAS 83136-28-1), with molecular formula C23H16O and molecular weight 308.12 g/mol. IUPAC: 7-methoxypentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,7,10,13,15,17,19,21-undecaene.
Chemical Property Profile of Dibenz(a,j)anthracene, 3-methoxy-
Property Insights of Dibenz(a,j)anthracene, 3-methoxy-
The XLogP value of 7.2 indicates that Dibenz(a,j)anthracene, 3-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Dibenz(a,j)anthracene, 3-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(a,j)anthracene, 3-methoxy- 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 Dibenz(a,j)anthracene, 3-methoxy-?
The CAS number of Dibenz(a,j)anthracene, 3-methoxy- is 83136-28-1.
What is the molecular formula of Dibenz(a,j)anthracene, 3-methoxy-?
The molecular formula of Dibenz(a,j)anthracene, 3-methoxy- is C23H16O.
What is the molecular weight of Dibenz(a,j)anthracene, 3-methoxy-?
The molecular weight of Dibenz(a,j)anthracene, 3-methoxy- is 308.12 g/mol.
Where can I buy Dibenz(a,j)anthracene, 3-methoxy-?
You can request a quote for Dibenz(a,j)anthracene, 3-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenz(a,j)anthracene, 3-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Dibenz(a,j)anthracene, 3-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.