C.I. Mordant Blue 13
TL;DR: C.I. Mordant Blue 13 (CAS 7361-97-9) is a chemical compound with molecular formula C16H11ClN2O9S2 and molecular weight 473.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-chloro-2-hydroxyphenyl)diazenyl]-4,5-dihydroxynaphthalene-2,7-disulfonic acid
Also Known As: C.I. Mordant Blue 13, Mordant blue 13 (C.I. 16680), (3Z)-3-[(5-chloro-2-hydroxyphenyl)hydrazinylidene]-5-hydroxy, 1,8-Dihydroxy-2-(2-hydroxy-5-chlorophenylazo)-3,6-naphthalenedisulfonic acid, 2,7-Naphthalenedisulfonic acid, 3-(3-chloro-6-hydroxyphenylazo)-4,5-dihydroxy-
| Molecular Formula | C16H11ClN2O9S2 |
|---|---|
| Molecular Weight | 473.96 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.95944 |
| Heavy Atoms | 30 |
| Complexity | 857.0 |
Chemical Identifiers
| CAS Number | 7361-97-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)O)O)O |
| InChIKey | KBLPVLOHGYMDQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
C.I. Mordant Blue 13 (CAS 7361-97-9), with molecular formula C16H11ClN2O9S2 and molecular weight 473.96 g/mol. IUPAC: 3-[(5-chloro-2-hydroxyphenyl)diazenyl]-4,5-dihydroxynaphthalene-2,7-disulfonic acid.
Chemical Property Profile of C.I. Mordant Blue 13
Property Insights of C.I. Mordant Blue 13
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C.I. Mordant Blue 13. The TPSA of 211.0 Ų indicates high polarity, suggesting C.I. Mordant Blue 13 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Mordant Blue 13 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C.I. Mordant Blue 13?
The CAS number of C.I. Mordant Blue 13 is 7361-97-9.
What is the molecular formula of C.I. Mordant Blue 13?
The molecular formula of C.I. Mordant Blue 13 is C16H11ClN2O9S2.
What is the molecular weight of C.I. Mordant Blue 13?
The molecular weight of C.I. Mordant Blue 13 is 473.96 g/mol.
Where can I buy C.I. Mordant Blue 13?
You can request a quote for C.I. Mordant Blue 13 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I. Mordant Blue 13?
Yes, KEHONG BIO provides custom synthesis services for C.I. Mordant Blue 13 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.