8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione
TL;DR: 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione (CAS 667-92-5) is a chemical compound with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2,2-dichloroacetyl)-5-hydroxy-2,7-dimethylnaphthalene-1,4-dione
Also Known As: Mollisin, Mollisine, n,n-bis (2-hydroxyethyl)tridecylamine, 1,4-Naphthoquinone, 8-(dichloroacetyl)-5-hydroxy-2,7-dimethyl-, 8-(2,2-dichloroacetyl)-5-hydroxy-2,7-dimethylnaphthalene-1,4-dione
| Molecular Formula | C14H10Cl2O4 |
|---|---|
| Molecular Weight | 312.00 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.9956 |
| Heavy Atoms | 20 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 667-92-5 |
|---|---|
| SMILES | CC1=CC(=C2C(=O)C=C(C(=O)C2=C1C(=O)C(Cl)Cl)C)O |
| InChIKey | LBLPBDUCKUHMIA-UHFFFAOYSA-N |
Product Overview
8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione (CAS 667-92-5), with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol. IUPAC: 8-(2,2-dichloroacetyl)-5-hydroxy-2,7-dimethylnaphthalene-1,4-dione.
Chemical Property Profile of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione
Property Insights of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione
The XLogP value of 3.4 indicates that 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione. Following Lipinski's Rule of Five, 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione has 1 hydrogen bond donor(s) and 4 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 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione?
The CAS number of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione is 667-92-5.
What is the molecular formula of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione?
The molecular formula of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione is C14H10Cl2O4.
What is the molecular weight of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione?
The molecular weight of 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione is 312.00 g/mol.
Where can I buy 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione?
You can request a quote for 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione?
Yes, KEHONG BIO provides custom synthesis services for 8-(2,2-Dichloroacetyl)-5-hydroxy-2,7-dimethyl-1,4-naphthalenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.