Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate
TL;DR: Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate (CAS 6363-92-4) is a chemical compound with molecular formula C16H9ClO4 and molecular weight 300.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-chloro-9,10-dioxoanthracene-2-carboxylate
Also Known As: methyl 1-chloro-9,10-dioxoanthracene-2-carboxylate, methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate, 2-Anthroic acid, 1-chloro-9,10-dihydro-9,10-dioxo-, methyl ester, 1-Chlor-9,10-dioxo-9,10-dihydro-anthracen-2-carbonsaeure-methylester, 2-Anthracenecarboxylic acid, 1-chloro-9,10-dihydro-9,10-dioxo-, methyl ester
| Molecular Formula | C16H9ClO4 |
|---|---|
| Molecular Weight | 300.02 g/mol |
| LogP | 2.902 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.01895 |
| Heavy Atoms | 21 |
| Complexity | 807.91943 |
Chemical Identifiers
| CAS Number | 6363-92-4 |
|---|---|
| SMILES | COC(=O)C1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)Cl |
Product Overview
Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate (CAS 6363-92-4), with molecular formula C16H9ClO4 and molecular weight 300.02 g/mol. IUPAC: methyl 1-chloro-9,10-dioxoanthracene-2-carboxylate.
Chemical Property Profile of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate
Property Insights of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate
The XLogP value of 2.902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate has 0 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 Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate?
The CAS number of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate is 6363-92-4.
What is the molecular formula of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate?
The molecular formula of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate is C16H9ClO4.
What is the molecular weight of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate?
The molecular weight of Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate is 300.02 g/mol.
Where can I buy Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate?
You can request a quote for Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-chloro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.