(E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
TL;DR: (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one (CAS 84933-55-1) is a chemical compound with molecular formula C12H11BrO2 and molecular weight 265.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
Also Known As: (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one, (2E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
| Molecular Formula | C12H11BrO2 |
|---|---|
| Molecular Weight | 265.99 g/mol |
| LogP | 2.8203 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.99423 |
| Heavy Atoms | 15 |
| Complexity | 419.38522 |
Chemical Identifiers
| CAS Number | 84933-55-1 |
|---|---|
| SMILES | CC1(CO1)C(=O)/C=C/C2=CC(=CC=C2)Br |
Product Overview
(E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one (CAS 84933-55-1), with molecular formula C12H11BrO2 and molecular weight 265.99 g/mol. IUPAC: (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one.
Chemical Property Profile of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
Property Insights of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
The XLogP value of 2.8203 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one. With a topological polar surface area (TPSA) of 29.6 Ų, (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-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 (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The CAS number of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is 84933-55-1.
What is the molecular formula of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The molecular formula of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is C12H11BrO2.
What is the molecular weight of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The molecular weight of (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is 265.99 g/mol.
Where can I buy (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
You can request a quote for (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3-bromophenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.