1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one
TL;DR: 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one (CAS 133473-98-0) is a chemical compound with molecular formula C10H7Cl3O2 and molecular weight 263.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3-trichloro-1-(4-methoxyphenyl)prop-2-en-1-one
Also Known As: 2,3,3-trichloro-1-(4-methoxyphenyl)prop-2-en-1-one, 2,3,3-Trichloro-1-(4-methoxy-phenyl)-propenone, 1-(4-METHOXYPHENYL)-2,3,3-TRICHLORO-2-PROPEN-1-ONE
| Molecular Formula | C10H7Cl3O2 |
|---|---|
| Molecular Weight | 263.95 g/mol |
| LogP | 3.7634 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.95117 |
| Heavy Atoms | 15 |
| Complexity | 391.63345 |
Chemical Identifiers
| CAS Number | 133473-98-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C(=C(Cl)Cl)Cl |
Product Overview
1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one (CAS 133473-98-0), with molecular formula C10H7Cl3O2 and molecular weight 263.95 g/mol. IUPAC: 2,3,3-trichloro-1-(4-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one
Property Insights of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one
The XLogP value of 3.7634 indicates that 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one 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 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one?
The CAS number of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one is 133473-98-0.
What is the molecular formula of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one?
The molecular formula of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one is C10H7Cl3O2.
What is the molecular weight of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one?
The molecular weight of 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one is 263.95 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one?
You can request a quote for 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-2,3,3-trichloro-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.