9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-
TL;DR: 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- (CAS 56594-25-3) is a chemical compound with molecular formula C15H9Cl2NO2 and molecular weight 305.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-chloro-2-(chloromethyl)anthracene-9,10-dione
Also Known As: 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-, 1-Amino-4-chloro-2-(chloromethyl)anthraquinone, J1.619.230I, 1-Amino-4-chloro-2-(chloromethyl)-9,10-anthracenedione, 1-amino-4-chloro-2-(chloromethyl)anthracene-9,10-dione
| Molecular Formula | C15H9Cl2NO2 |
|---|---|
| Molecular Weight | 305.00 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.00104 |
| Heavy Atoms | 20 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 56594-25-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)N)CCl)Cl |
| InChIKey | VYDBGDWGXAUZAP-UHFFFAOYSA-N |
Product Overview
9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- (CAS 56594-25-3), with molecular formula C15H9Cl2NO2 and molecular weight 305.00 g/mol. IUPAC: 1-amino-4-chloro-2-(chloromethyl)anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-
Property Insights of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-
The XLogP value of 3.8 indicates that 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- has 1 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 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-?
The CAS number of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- is 56594-25-3.
What is the molecular formula of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-?
The molecular formula of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- is C15H9Cl2NO2.
What is the molecular weight of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-?
The molecular weight of 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- is 305.00 g/mol.
Where can I buy 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-?
You can request a quote for 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-amino-4-chloro-2-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.