(3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one
TL;DR: (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one (CAS 111395-44-9) is a chemical compound with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethyl-3-nitroso-1H-indol-2-ol
Also Known As: 3-(hydroxyamino)-6,7-dimethylindol-2-one, 3-(hydroxyamino)-6,7-dimethyl-2H-indol-2-one, 3-(hydroxyimino)-6,7-dimethyl-2,3-dihydro-1H-indol-2-one, (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one, (3E)-6,7-dimethyl-3-(oxido-lambda~5~-azanylidene)-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C10H10N2O2 |
|---|---|
| Molecular Weight | 190.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.07423 |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 111395-44-9 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C(=C(N2)O)N=O)C |
| InChIKey | KNZJFQYGISKCOW-UHFFFAOYSA-N |
Product Overview
(3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one (CAS 111395-44-9), with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol. IUPAC: 6,7-dimethyl-3-nitroso-1H-indol-2-ol.
Chemical Property Profile of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one
Property Insights of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one. Following Lipinski's Rule of Five, (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one has 2 hydrogen bond donor(s) and 3 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 (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one?
The CAS number of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one is 111395-44-9.
What is the molecular formula of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one?
The molecular formula of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one is C10H10N2O2.
What is the molecular weight of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one?
The molecular weight of (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one is 190.07 g/mol.
Where can I buy (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one?
You can request a quote for (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-3-(hydroxyimino)-6,7-dimethyl-1,3-dihydro-2H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.