1-(4-Dodecylanilino)anthraquinone
TL;DR: 1-(4-Dodecylanilino)anthraquinone (CAS 42887-27-4) is a chemical compound with molecular formula C32H37NO2 and molecular weight 467.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-dodecylanilino)anthracene-9,10-dione
Also Known As: 1-(p-Dodecylanilino)anthraquinone, 1-(4-Dodecylanilino)anthraquinone, 1-[ amino]anthraquinone, 1-(4-dodecylanilino)anthracene-9,10-dione, 1-((4-Dodecylphenyl)amino)anthraquinone
| Molecular Formula | C32H37NO2 |
|---|---|
| Molecular Weight | 467.28 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 467.28244 |
| Heavy Atoms | 35 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 42887-27-4 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O |
| InChIKey | CXBWUYBJZCGEOL-UHFFFAOYSA-N |
Product Overview
1-(4-Dodecylanilino)anthraquinone (CAS 42887-27-4), with molecular formula C32H37NO2 and molecular weight 467.28 g/mol. IUPAC: 1-(4-dodecylanilino)anthracene-9,10-dione.
Chemical Property Profile of 1-(4-Dodecylanilino)anthraquinone
Property Insights of 1-(4-Dodecylanilino)anthraquinone
The XLogP value of 11.1 indicates that 1-(4-Dodecylanilino)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 1-(4-Dodecylanilino)anthraquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Dodecylanilino)anthraquinone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Dodecylanilino)anthraquinone?
The CAS number of 1-(4-Dodecylanilino)anthraquinone is 42887-27-4.
What is the molecular formula of 1-(4-Dodecylanilino)anthraquinone?
The molecular formula of 1-(4-Dodecylanilino)anthraquinone is C32H37NO2.
What is the molecular weight of 1-(4-Dodecylanilino)anthraquinone?
The molecular weight of 1-(4-Dodecylanilino)anthraquinone is 467.28 g/mol.
Where can I buy 1-(4-Dodecylanilino)anthraquinone?
You can request a quote for 1-(4-Dodecylanilino)anthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Dodecylanilino)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Dodecylanilino)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.