3-(4-Acetamidophenyl)propanal
TL;DR: 3-(4-Acetamidophenyl)propanal (CAS 169054-06-2) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(3-oxopropyl)phenyl]acetamide
Also Known As: N-[4-(3-oxopropyl)phenyl]acetamide, 3-(4-acetamidophenyl)propanal, Acetamide, N-[4-(3-oxopropyl)phenyl]-, 4 -(3-Oxopropyl)acetoanilide, 3-[4-(Acetylamino)phenyl]propanal
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.7765 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 316.56433 |
Chemical Identifiers
| CAS Number | 169054-06-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)CCC=O |
Product Overview
3-(4-Acetamidophenyl)propanal (CAS 169054-06-2), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: N-[4-(3-oxopropyl)phenyl]acetamide.
Chemical Property Profile of 3-(4-Acetamidophenyl)propanal
Property Insights of 3-(4-Acetamidophenyl)propanal
The XLogP value of 1.7765 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Acetamidophenyl)propanal. With a topological polar surface area (TPSA) of 46.17 Ų, 3-(4-Acetamidophenyl)propanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Acetamidophenyl)propanal 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 3-(4-Acetamidophenyl)propanal?
The CAS number of 3-(4-Acetamidophenyl)propanal is 169054-06-2.
What is the molecular formula of 3-(4-Acetamidophenyl)propanal?
The molecular formula of 3-(4-Acetamidophenyl)propanal is C11H13NO2.
What is the molecular weight of 3-(4-Acetamidophenyl)propanal?
The molecular weight of 3-(4-Acetamidophenyl)propanal is 191.09 g/mol.
Where can I buy 3-(4-Acetamidophenyl)propanal?
You can request a quote for 3-(4-Acetamidophenyl)propanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Acetamidophenyl)propanal?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Acetamidophenyl)propanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.