Einecs 272-622-2
TL;DR: Einecs 272-622-2 (CAS 68900-72-1) is a chemical compound with molecular formula C24H23ClCrN5O6S and molecular weight 596.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[bis(2-hydroxyethyl)sulfamoyl]-2-oxidonaphthalen-1-yl]diazenyl]-3-methyl-1-phenylpyrazol-5-olate;chromium(3+);chloride
Also Known As: 1,3,5-tris(2-methylphenyl)-1,3,5-triazinane trihydrochloride, chromium(3+) chloride 4-[(e)-{4-[bis(2-hydroxyethyl)sulfamoyl]-2-oxidonaphthalen-1-yl}diazenyl]-3-methyl-1-phenyl-1h-pyrazol-5-olate(1:1:1), (4-((4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-3-hydroxy-N,N-bis(2-hydroxyethyl)naphthalene-1-sulphonamidato(2-))chromium(1-) chloride, 4-[[4-[bis(2-hydroxyethyl)sulfamoyl]-2-oxidonaphthalen-1-yl]diazenyl]-5-methyl-2-phenylpyrazol-3-olate; chromium(3+); chloride, Chromium(1+), (4-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-3-hydroxy-N,N-bis(2-hydroxyethyl)-1-naphthalenesulfonamidato(2-))-, chloride
| Molecular Formula | C24H23ClCrN5O6S |
|---|---|
| Molecular Weight | 596.05 g/mol |
| LogP | -1.13 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 596.04626 |
| Heavy Atoms | 38 |
| Complexity | 829.0 |
Chemical Identifiers
| CAS Number | 68900-72-1 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)N(CCO)CCO)[O-])[O-])C4=CC=CC=C4.[Cl-].[Cr+3] |
| InChIKey | ZJHGXSIKKGAFIG-UHFFFAOYSA-K |
Product Overview
Einecs 272-622-2 (CAS 68900-72-1), with molecular formula C24H23ClCrN5O6S and molecular weight 596.05 g/mol. IUPAC: 4-[[4-[bis(2-hydroxyethyl)sulfamoyl]-2-oxidonaphthalen-1-yl]diazenyl]-3-methyl-1-phenylpyrazol-5-olate;chromium(3+);chloride.
Chemical Property Profile of Einecs 272-622-2
Property Insights of Einecs 272-622-2
The XLogP value of -1.13 indicates that Einecs 272-622-2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting Einecs 272-622-2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 272-622-2 has 2 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 Einecs 272-622-2?
The CAS number of Einecs 272-622-2 is 68900-72-1.
What is the molecular formula of Einecs 272-622-2?
The molecular formula of Einecs 272-622-2 is C24H23ClCrN5O6S.
What is the molecular weight of Einecs 272-622-2?
The molecular weight of Einecs 272-622-2 is 596.05 g/mol.
Where can I buy Einecs 272-622-2?
You can request a quote for Einecs 272-622-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 272-622-2?
Yes, KEHONG BIO provides custom synthesis services for Einecs 272-622-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.