9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-
TL;DR: 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- (CAS 12217-79-7) is a chemical compound with molecular formula C14H9ClN2O4 and molecular weight 304.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-diamino-2-chloro-4,8-dihydroxyanthracene-9,10-dione
Also Known As: Disperse Blue 56, Latyl Blue BCN, Resolin Blue FBL, Samaron Blue FBL, C.I. Disperse Blue 56
| Molecular Formula | C14H9ClN2O4 |
|---|---|
| Molecular Weight | 304.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.0251 |
| Heavy Atoms | 21 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 12217-79-7 |
|---|---|
| SMILES | C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C=C3O)Cl)N)O |
| InChIKey | SIRMWLMEYFPGAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- (CAS 12217-79-7), with molecular formula C14H9ClN2O4 and molecular weight 304.03 g/mol. IUPAC: 1,5-diamino-2-chloro-4,8-dihydroxyanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-
Property Insights of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- has 4 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 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-?
The CAS number of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- is 12217-79-7.
What is the molecular formula of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-?
The molecular formula of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- is C14H9ClN2O4.
What is the molecular weight of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-?
The molecular weight of 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- is 304.03 g/mol.
Where can I buy 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy-?
You can request a quote for 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- 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, 1,5-diaminochloro-4,8-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,5-diaminochloro-4,8-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.