![4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one structure](/static/products/1608/16089-67-1.webp)
4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one
TL;DR: 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one (CAS 16089-67-1) is a chemical compound with molecular formula C8H9NO2 and molecular weight 151.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one
Also Known As: Phenol, 4-[(methylimino)methyl]-N-oxide, N-methyl-c-(4-hydroxylphenyl) nitrone, N-Methyl-4-hydroxyphenylmethanimine N-oxide, Phenol, 4-((methylimino)methyl)-, N-oxide, <4-Hydroxy-benzyliden>-methyl-amin-N-oxid
| Molecular Formula | C8H9NO2 |
|---|---|
| Molecular Weight | 151.06 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.06332 |
| Heavy Atoms | 11 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 16089-67-1 |
|---|---|
| SMILES | CN(C=C1C=CC(=O)C=C1)O |
| InChIKey | JBZBGEGMQNXLMG-UHFFFAOYSA-N |
Product Overview
4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one (CAS 16089-67-1), with molecular formula C8H9NO2 and molecular weight 151.06 g/mol. IUPAC: 4-[[hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one.
Chemical Property Profile of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one
Property Insights of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one. With a topological polar surface area (TPSA) of 40.5 Ų, 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one has 1 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 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one?
The CAS number of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one is 16089-67-1.
What is the molecular formula of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one?
The molecular formula of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one is C8H9NO2.
What is the molecular weight of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one?
The molecular weight of 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one is 151.06 g/mol.
Where can I buy 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one?
You can request a quote for 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[[Hydroxy(methyl)amino]methylidene]cyclohexa-2,5-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.