1-Butanone, 1-(4-aminophenyl)-
TL;DR: 1-Butanone, 1-(4-aminophenyl)- (CAS 1688-71-7) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-aminophenyl)butan-1-one
Also Known As: 4'-Aminobutyrophenone, 1-(4-aminophenyl)butan-1-one, p-Aminobutyrophenone, 1-Butanone, 1-(4-aminophenyl)-, 4-aminobutyrophenone
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 1688-71-7 |
|---|---|
| SMILES | CCCC(=O)C1=CC=C(C=C1)N |
| InChIKey | CYCSOZSEBPZGPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanone, 1-(4-aminophenyl)- (CAS 1688-71-7), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: 1-(4-aminophenyl)butan-1-one.
Chemical Property Profile of 1-Butanone, 1-(4-aminophenyl)-
Property Insights of 1-Butanone, 1-(4-aminophenyl)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanone, 1-(4-aminophenyl)-. With a topological polar surface area (TPSA) of 43.1 Ų, 1-Butanone, 1-(4-aminophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 1-(4-aminophenyl)- 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 1-Butanone, 1-(4-aminophenyl)-?
The CAS number of 1-Butanone, 1-(4-aminophenyl)- is 1688-71-7.
What is the molecular formula of 1-Butanone, 1-(4-aminophenyl)-?
The molecular formula of 1-Butanone, 1-(4-aminophenyl)- is C10H13NO.
What is the molecular weight of 1-Butanone, 1-(4-aminophenyl)-?
The molecular weight of 1-Butanone, 1-(4-aminophenyl)- is 163.10 g/mol.
Where can I buy 1-Butanone, 1-(4-aminophenyl)-?
You can request a quote for 1-Butanone, 1-(4-aminophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-(4-aminophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-(4-aminophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.