![2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one structure](/static/products/321/321695-50-5.png)
2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one
TL;DR: 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one (CAS 321695-50-5) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-phenylprop-2-enoate
Also Known As: 2,5-dimethylbenzo-1,4-quinone 1-(O-cinnamoyloxime), [(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-phenylprop-2-enoate, 2,5-dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one
| Molecular Formula | C17H15NO3 |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 55.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.1052 |
| Heavy Atoms | 21 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 321695-50-5 |
|---|---|
| SMILES | CC1=CC(=NOC(=O)C=CC2=CC=CC=C2)C(=CC1=O)C |
| InChIKey | SSJPFXXSBQHXNP-UHFFFAOYSA-N |
Product Overview
2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one (CAS 321695-50-5), with molecular formula C17H15NO3 and molecular weight 281.11 g/mol. IUPAC: [(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-phenylprop-2-enoate.
Chemical Property Profile of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one
Property Insights of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one
The XLogP value of 3.2 indicates that 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.7 Ų, 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one has 0 hydrogen bond donor(s) and 4 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 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one?
The CAS number of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one is 321695-50-5.
What is the molecular formula of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one?
The molecular formula of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one is C17H15NO3.
What is the molecular weight of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one?
The molecular weight of 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one is 281.11 g/mol.
Where can I buy 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one?
You can request a quote for 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}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 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-4-{[(3-phenylprop-2-enoyl)oxy]-imino}cyclohexa-2,5-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.