4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime
TL;DR: 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime (CAS 99684-91-0) is a chemical compound with molecular formula C9H8ClN3O4 and molecular weight 257.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-hydroxyimino-6-methoxy-1-nitroso-2H-indol-2-ol
Also Known As: CMNIO, 4-chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime, 4-Chloro-6-methoxy-2-hydroxy-N(1)-nitrosoindolin-3-one oxime, 4-chloro-3-hydroxyimino-6-methoxy-1-nitroso-2H-indol-2-ol, 4-Chloro-6-methoxy-2-hydroxy-1-nitrosoindolin-3-one oxime
| Molecular Formula | C9H8ClN3O4 |
|---|---|
| Molecular Weight | 257.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 94.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.02032 |
| Heavy Atoms | 17 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 99684-91-0 |
|---|---|
| SMILES | COC1=CC2=C(C(=C1)Cl)C(=NO)C(N2N=O)O |
| InChIKey | GKEJGZOTLCPFHM-UHFFFAOYSA-N |
Product Overview
4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime (CAS 99684-91-0), with molecular formula C9H8ClN3O4 and molecular weight 257.02 g/mol. IUPAC: 4-chloro-3-hydroxyimino-6-methoxy-1-nitroso-2H-indol-2-ol.
Chemical Property Profile of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime
Property Insights of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime. Following Lipinski's Rule of Five, 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime has 2 hydrogen bond donor(s) and 7 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 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime?
The CAS number of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime is 99684-91-0.
What is the molecular formula of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime?
The molecular formula of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime is C9H8ClN3O4.
What is the molecular weight of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime?
The molecular weight of 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime is 257.02 g/mol.
Where can I buy 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime?
You can request a quote for 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-6-methoxy-2-hydroxy-1-nitroso-indolin-3-one oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.