Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
TL;DR: Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide (CAS 65194-06-1) is a chemical compound with molecular formula C8H9NO and molecular weight 135.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methylcyclohepta-2,4,6-trien-1-imine oxide
Also Known As: ditridecyl ether, N-methylcyclohepta-2,4,6-trien-1-imine oxide, Methyl(2,4,6-cycloheptatrien-1-ylidene)amine N-oxide, 7-(METHYLNITROSO)CYCLOHEPTA-1,3,5-TRIENE, Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
| Molecular Formula | C8H9NO |
|---|---|
| Molecular Weight | 135.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.06842 |
| Heavy Atoms | 10 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 65194-06-1 |
|---|---|
| SMILES | C[N+](=C1C=CC=CC=C1)[O-] |
| InChIKey | CXRMQJPLOWKRJD-UHFFFAOYSA-N |
Product Overview
Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide (CAS 65194-06-1), with molecular formula C8H9NO and molecular weight 135.07 g/mol. IUPAC: N-methylcyclohepta-2,4,6-trien-1-imine oxide.
Chemical Property Profile of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
Property Insights of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide. With a topological polar surface area (TPSA) of 28.8 Ų, Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide has 0 hydrogen bond donor(s) and 1 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 Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide?
The CAS number of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is 65194-06-1.
What is the molecular formula of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide?
The molecular formula of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is C8H9NO.
What is the molecular weight of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide?
The molecular weight of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is 135.07 g/mol.
Where can I buy Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide?
You can request a quote for Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide?
Yes, KEHONG BIO provides custom synthesis services for Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.