3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)
TL;DR: 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) (CAS 24206-71-1) 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.
3-methyl-3-(methylamino)-1-phenylbutan-1-one;hydrochloride
Also Known As: 2,2-Dimethyl-3-(methylamino)propiophenone hydrochloride, 3-methyl-3-(methylamino)-1-phenylbutan-1-one hydrochloride, 3-methyl-3-(methylamino)-1-phenylbutan-1-one hydrochloride(1:1), Propiophenone, 2,2-dimethyl-3-(methylamino)-, hydrochloride, 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)
| Molecular Formula | C12H18ClNO |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 2.68 |
| 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 | 192.0 |
Chemical Identifiers
| CAS Number | 24206-71-1 |
|---|---|
| SMILES | CC(C)(CC(=O)C1=CC=CC=C1)NC.Cl |
| InChIKey | YXNTXDQIDINLRU-UHFFFAOYSA-N |
Product Overview
3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) (CAS 24206-71-1), with molecular formula C12H18ClNO and molecular weight 227.11 g/mol. IUPAC: 3-methyl-3-(methylamino)-1-phenylbutan-1-one;hydrochloride.
Chemical Property Profile of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)
Property Insights of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)
The XLogP value of 2.68 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 29.1 Ų, 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) 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 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)?
The CAS number of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) is 24206-71-1.
What is the molecular formula of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)?
The molecular formula of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) is C12H18ClNO.
What is the molecular weight of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)?
The molecular weight of 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) is 227.11 g/mol.
Where can I buy 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)?
You can request a quote for 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3-(methylamino)-1-phenylbutan-1-one--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.