N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide
TL;DR: N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide (CAS 636-15-7) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxyphenyl)methylidene]acetamide
Also Known As: Salicylideneacetamide, N-Salicylideneacetamide, N-[(2-hydroxyphenyl)methylidene]acetamide, N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide, N-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 636-15-7 |
|---|---|
| SMILES | CC(=O)N=CC1=CC=CC=C1O |
| InChIKey | VBPVHPHDUYLNHQ-UHFFFAOYSA-N |
Product Overview
N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide (CAS 636-15-7), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: N-[(2-hydroxyphenyl)methylidene]acetamide.
Chemical Property Profile of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide
Property Insights of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide. With a topological polar surface area (TPSA) of 49.7 Ų, N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide has 1 hydrogen bond donor(s) and 2 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 N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide?
The CAS number of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide is 636-15-7.
What is the molecular formula of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide?
The molecular formula of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide is C9H9NO2.
What is the molecular weight of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide?
The molecular weight of N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide is 163.06 g/mol.
Where can I buy N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide?
You can request a quote for N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.