10-Ethyldithranol
TL;DR: 10-Ethyldithranol (CAS 104608-82-4) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-ethyl-1,8-dihydroxy-10H-anthracen-9-one
Also Known As: 10-Ethyldithranol, 1,8-Dihydroxy-10-ethylanthrone, 10-Ethyl-1,8-dihydroxy-10H-anthracen-9-one, 1,8-Dihydroxy-10-ethyl-9(10H)-anthracenone, 10-ethyl-1,8-dihydroxyanthracen-9(10H)-one
| Molecular Formula | C16H14O3 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.0943 |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 104608-82-4 |
|---|---|
| SMILES | CCC1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O |
| InChIKey | HQHJGYHOFVZUIM-UHFFFAOYSA-N |
Product Overview
10-Ethyldithranol (CAS 104608-82-4), with molecular formula C16H14O3 and molecular weight 254.09 g/mol. IUPAC: 10-ethyl-1,8-dihydroxy-10H-anthracen-9-one.
Chemical Property Profile of 10-Ethyldithranol
Property Insights of 10-Ethyldithranol
The XLogP value of 4.1 indicates that 10-Ethyldithranol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 10-Ethyldithranol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-Ethyldithranol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 10-Ethyldithranol?
The CAS number of 10-Ethyldithranol is 104608-82-4.
What is the molecular formula of 10-Ethyldithranol?
The molecular formula of 10-Ethyldithranol is C16H14O3.
What is the molecular weight of 10-Ethyldithranol?
The molecular weight of 10-Ethyldithranol is 254.09 g/mol.
Where can I buy 10-Ethyldithranol?
You can request a quote for 10-Ethyldithranol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-Ethyldithranol?
Yes, KEHONG BIO provides custom synthesis services for 10-Ethyldithranol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.