Reactive Orange 12
TL;DR: Reactive Orange 12 (CAS 70161-14-7) is a chemical compound with molecular formula C20H13ClN9Na3O10S3 and molecular weight 738.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;7-[[4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-(carbamoylamino)phenyl]diazenyl]naphthalene-1,3,6-trisulfonate
Also Known As: Reactive orange 12, C.I. Reactive Orange 12, Reactive orange 12(c.i. 13248), REACTIVE ORANGE 12 (C.I. 13248), 1,3,6-Naphthalenetrisulfonic acid, 7-[[2-[(aminocarbonyl)amino]-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]azo]-, trisodium salt
| Molecular Formula | C20H13ClN9Na3O10S3 |
|---|---|
| Molecular Weight | 738.93 g/mol |
| LogP | -7.37 |
| Topological Polar Surface Area | 353.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 5 |
| Exact Mass | 738.9329 |
| Heavy Atoms | 46 |
| Complexity | 1330.0 |
Chemical Identifiers
| CAS Number | 70161-14-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=NC(=NC(=N2)N)Cl)NC(=O)N)N=NC3=CC4=C(C=C(C=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | DSKGJDYCSBLEMI-UHFFFAOYSA-K |
Product Overview
Reactive Orange 12 (CAS 70161-14-7), with molecular formula C20H13ClN9Na3O10S3 and molecular weight 738.93 g/mol. IUPAC: trisodium;7-[[4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-(carbamoylamino)phenyl]diazenyl]naphthalene-1,3,6-trisulfonate.
Chemical Property Profile of Reactive Orange 12
Property Insights of Reactive Orange 12
The XLogP value of -7.37 indicates that Reactive Orange 12 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 353.0 Ų indicates high polarity, suggesting Reactive Orange 12 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reactive Orange 12 has 4 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Reactive Orange 12?
The CAS number of Reactive Orange 12 is 70161-14-7.
What is the molecular formula of Reactive Orange 12?
The molecular formula of Reactive Orange 12 is C20H13ClN9Na3O10S3.
What is the molecular weight of Reactive Orange 12?
The molecular weight of Reactive Orange 12 is 738.93 g/mol.
Where can I buy Reactive Orange 12?
You can request a quote for Reactive Orange 12 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Reactive Orange 12?
Yes, KEHONG BIO provides custom synthesis services for Reactive Orange 12 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.