4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one
TL;DR: 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one (CAS 306979-75-9) is a chemical compound with molecular formula C14H18ClNO2 and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chloro-2-methylphenoxy)-1-(dimethylamino)pent-1-en-3-one
Also Known As: 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one, 4-(4-chloro-2-methylphenoxy)-1-(dimethylamino)-1-penten-3-one, 4-(4-chloro-2-methylphenoxy)-1-(dimethylamino)pent-1-en-3-one
| Molecular Formula | C14H18ClNO2 |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 3.06012 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.1026 |
| Heavy Atoms | 18 |
| Complexity | 455.10727 |
Chemical Identifiers
| CAS Number | 306979-75-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OC(C)C(=O)C=CN(C)C |
Product Overview
4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one (CAS 306979-75-9), with molecular formula C14H18ClNO2 and molecular weight 267.10 g/mol. IUPAC: 4-(4-chloro-2-methylphenoxy)-1-(dimethylamino)pent-1-en-3-one.
Chemical Property Profile of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one
Property Insights of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one
The XLogP value of 3.06012 indicates that 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one has 0 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 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one?
The CAS number of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one is 306979-75-9.
What is the molecular formula of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one?
The molecular formula of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one is C14H18ClNO2.
What is the molecular weight of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one?
The molecular weight of 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one is 267.10 g/mol.
Where can I buy 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one?
You can request a quote for 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-chloro-2-methyl-phenoxy)-1-dimethylamino-pent-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.