Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate
TL;DR: Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate (CAS 30105-41-0) is a chemical compound with molecular formula C21H21NO5 and molecular weight 367.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(10-hydroxyimino-9H-anthracen-9-yl)propanedioate
Also Known As: diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate, diethyl 2-(10-hydroxyimino-9H-anthracen-9-yl)propanedioate, Diethyl [10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate
| Molecular Formula | C21H21NO5 |
|---|---|
| Molecular Weight | 367.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 85.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.14197 |
| Heavy Atoms | 27 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 30105-41-0 |
|---|---|
| SMILES | CCOC(=O)C(C1C2=CC=CC=C2C(=NO)C3=CC=CC=C13)C(=O)OCC |
| InChIKey | MSSWNZXPMGDOEG-UHFFFAOYSA-N |
Product Overview
Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate (CAS 30105-41-0), with molecular formula C21H21NO5 and molecular weight 367.14 g/mol. IUPAC: diethyl 2-(10-hydroxyimino-9H-anthracen-9-yl)propanedioate.
Chemical Property Profile of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate
Property Insights of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate
The XLogP value of 4.1 indicates that Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate. Following Lipinski's Rule of Five, Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate has 1 hydrogen bond donor(s) and 6 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 Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate?
The CAS number of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate is 30105-41-0.
What is the molecular formula of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate?
The molecular formula of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate is C21H21NO5.
What is the molecular weight of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate?
The molecular weight of Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate is 367.14 g/mol.
Where can I buy Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate?
You can request a quote for Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl[10-(hydroxyimino)-9,10-dihydroanthracen-9-yl]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.