3-Amino-1-(4-methoxyphenyl)but-2-en-1-one
TL;DR: 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one (CAS 102252-89-1) 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.
3-amino-1-(4-methoxyphenyl)but-2-en-1-one
Also Known As: 3-amino-1-(4-methoxyphenyl)but-2-en-1-one, 3-(4-methoxyphenyl)-1-methyl-3-oxo-1-propenamine, 3-Amino-1-(4-methoxyphenyl)-2-buten-1-one, 3-Amino-1-(4-methoxy-phenyl)-but-2-en-1-one, A3209/0136102
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.7404 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 348.0552 |
Chemical Identifiers
| CAS Number | 102252-89-1 |
|---|---|
| SMILES | CC(=CC(=O)C1=CC=C(C=C1)OC)N |
Product Overview
3-Amino-1-(4-methoxyphenyl)but-2-en-1-one (CAS 102252-89-1), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 3-amino-1-(4-methoxyphenyl)but-2-en-1-one.
Chemical Property Profile of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one
Property Insights of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one
The XLogP value of 1.7404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one. With a topological polar surface area (TPSA) of 52.32 Ų, 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-(4-methoxyphenyl)but-2-en-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 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one?
The CAS number of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one is 102252-89-1.
What is the molecular formula of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one?
The molecular formula of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one is C11H13NO2.
What is the molecular weight of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one?
The molecular weight of 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one is 191.09 g/mol.
Where can I buy 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one?
You can request a quote for 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-(4-methoxyphenyl)but-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.