5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride
TL;DR: 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride (CAS 54951-56-3) is a chemical compound with molecular formula C14H20ClNO and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-(dimethylamino)-4-methyl-1-phenylpent-1-en-3-one;hydrochloride
Also Known As: NIOSH/SB3882370, 1-Penten-3-one, hydrochloride, (E)-, 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride, (E)-5-(dimethylamino)-4-methyl-1-phenylpent-1-en-3-one;hydrochloride, (E)-5-(dimethylamino)-4-methyl-1-phenylpent-1-en-3-one,hydro
| Molecular Formula | C14H20ClNO |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 2.8884 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.12334 |
| Heavy Atoms | 17 |
| Complexity | 359.74478 |
Chemical Identifiers
| CAS Number | 54951-56-3 |
|---|---|
| SMILES | CC(CN(C)C)C(=O)/C=C/C1=CC=CC=C1.Cl |
Product Overview
5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride (CAS 54951-56-3), with molecular formula C14H20ClNO and molecular weight 253.12 g/mol. IUPAC: (E)-5-(dimethylamino)-4-methyl-1-phenylpent-1-en-3-one;hydrochloride.
Chemical Property Profile of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride
Property Insights of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride
The XLogP value of 2.8884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride. With a topological polar surface area (TPSA) of 20.31 Ų, 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride has 0 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 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride?
The CAS number of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride is 54951-56-3.
What is the molecular formula of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride?
The molecular formula of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride is C14H20ClNO.
What is the molecular weight of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride?
The molecular weight of 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride is 253.12 g/mol.
Where can I buy 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride?
You can request a quote for 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-4-methyl-1-phenyl-1-penten-3-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.