CID 106000
TL;DR: CID 106000 (CAS 67893-10-1) is a chemical compound with molecular formula C16H15CrN5NaO10S and molecular weight 543.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;chromium(3+);4-[3-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-5-oxidopyrazol-1-yl]benzenesulfonate;hydroxide;dihydrate
Also Known As: Chromate(1-), diaqua(4-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-nitrophenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonato(3-))hydroxy-, sodium, Chromate(1-), diaqua(4-(4,5-dihydro-4-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonato(3-))hydroxy-, sodium (1:1), Chromate(1-), triaqua(2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)azo)-4-nitrophenolato(3-))-, sodium
| Molecular Formula | C16H15CrN5NaO10S |
|---|---|
| Molecular Weight | 543.98 g/mol |
| LogP | -3.27 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 3 |
| Exact Mass | 543.98425 |
| Heavy Atoms | 34 |
| Complexity | 705.0 |
Chemical Identifiers
| CAS Number | 67893-10-1 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].O.O.[OH-].[Na+].[Cr+3] |
| InChIKey | AINLAQNPXAUIMI-UHFFFAOYSA-J |
Product Overview
CID 106000 (CAS 67893-10-1), with molecular formula C16H15CrN5NaO10S and molecular weight 543.98 g/mol. IUPAC: sodium;chromium(3+);4-[3-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-5-oxidopyrazol-1-yl]benzenesulfonate;hydroxide;dihydrate.
Chemical Property Profile of CID 106000
Property Insights of CID 106000
The XLogP value of -3.27 indicates that CID 106000 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 203.0 Ų indicates high polarity, suggesting CID 106000 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 106000 has 3 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CID 106000?
The CAS number of CID 106000 is 67893-10-1.
What is the molecular formula of CID 106000?
The molecular formula of CID 106000 is C16H15CrN5NaO10S.
What is the molecular weight of CID 106000?
The molecular weight of CID 106000 is 543.98 g/mol.
Where can I buy CID 106000?
You can request a quote for CID 106000 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 106000?
Yes, KEHONG BIO provides custom synthesis services for CID 106000 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.