1,5-Diaminoanthraquinone
TL;DR: 1,5-Diaminoanthraquinone (CAS 129-44-2) is a chemical compound with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-diaminoanthracene-9,10-dione
Also Known As: 1,5-DIAMINOANTHRAQUINONE, Smoke Red F, 1,5-diaminoanthracene-9,10-dione, C.I. Disperse Red II, 1,5-Diaminoanthrachinon
| Molecular Formula | C14H10N2O2 |
|---|---|
| Molecular Weight | 238.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.07423 |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 129-44-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C(=CC=C3)N |
| InChIKey | VWBVCOPVKXNMMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-Diaminoanthraquinone (CAS 129-44-2), with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol. IUPAC: 1,5-diaminoanthracene-9,10-dione.
Chemical Property Profile of 1,5-Diaminoanthraquinone
Property Insights of 1,5-Diaminoanthraquinone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Diaminoanthraquinone. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5-Diaminoanthraquinone. Following Lipinski's Rule of Five, 1,5-Diaminoanthraquinone has 2 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 1,5-Diaminoanthraquinone?
The CAS number of 1,5-Diaminoanthraquinone is 129-44-2.
What is the molecular formula of 1,5-Diaminoanthraquinone?
The molecular formula of 1,5-Diaminoanthraquinone is C14H10N2O2.
What is the molecular weight of 1,5-Diaminoanthraquinone?
The molecular weight of 1,5-Diaminoanthraquinone is 238.07 g/mol.
Where can I buy 1,5-Diaminoanthraquinone?
You can request a quote for 1,5-Diaminoanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Diaminoanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Diaminoanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.