![1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride structure](/static/products/5274/52741-17-0.webp)
1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride
TL;DR: 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride (CAS 52741-17-0) is a chemical compound with molecular formula C12H18ClNO and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-(propan-2-ylamino)propan-1-one;hydrochloride
Also Known As: alpha-Iso-propylaminopropiophenone, hydrochloride, 1-phenyl-2-(propan-2-ylamino)propan-1-one,hydrochloride, 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride, 1-phenyl-2-(propan-2-ylamino)propan-1-one hydrochloride, 1-Propanone,2-[(1-methylethyl)amino]-1-phenyl-,hydrochloride
| Molecular Formula | C12H18ClNO |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 2.6776 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.1077 |
| Heavy Atoms | 15 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 52741-17-0 |
|---|---|
| SMILES | CC(C)NC(C)C(=O)C1=CC=CC=C1.Cl |
| InChIKey | DVXIABKVTJBQMM-UHFFFAOYSA-N |
Product Overview
1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride (CAS 52741-17-0), with molecular formula C12H18ClNO and molecular weight 227.11 g/mol. IUPAC: 1-phenyl-2-(propan-2-ylamino)propan-1-one;hydrochloride.
Chemical Property Profile of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride
Property Insights of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride
The XLogP value of 2.6776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride. With a topological polar surface area (TPSA) of 29.1 Ų, 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride has 2 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-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride?
The CAS number of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride is 52741-17-0.
What is the molecular formula of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride?
The molecular formula of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride is C12H18ClNO.
What is the molecular weight of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride?
The molecular weight of 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride is 227.11 g/mol.
Where can I buy 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride?
You can request a quote for 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2-[(1-methylethyl)amino]-1-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.