Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-
TL;DR: Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- (CAS 54313-83-6) is a chemical compound with molecular formula C14H12BrNO and molecular weight 289.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-bromophenyl)-3-pyridin-3-ylprop-2-en-1-ol
Also Known As: Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-, 4-Bromo-alpha-(2-(3-pyridinyl)ethenyl)benzenemethanol, 5-21-04-00028 (Beilstein Handbook Reference), (Bromo-4 phenyl)-1 (pyridyl-3)-3 propen-2 ol-1, (Bromo-4 phenyl)-1 (pyridyl-3)-3 propen-2 ol-1 [French]
| Molecular Formula | C14H12BrNO |
|---|---|
| Molecular Weight | 289.01 g/mol |
| LogP | 3.5909 |
| Topological Polar Surface Area | 33.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.01022 |
| Heavy Atoms | 17 |
| Complexity | 493.39047 |
Chemical Identifiers
| CAS Number | 54313-83-6 |
|---|---|
| SMILES | C1=CC(=CN=C1)/C=C/C(C2=CC=C(C=C2)Br)O |
Product Overview
Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- (CAS 54313-83-6), with molecular formula C14H12BrNO and molecular weight 289.01 g/mol. IUPAC: (E)-1-(4-bromophenyl)-3-pyridin-3-ylprop-2-en-1-ol.
Chemical Property Profile of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-
Property Insights of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-
The XLogP value of 3.5909 indicates that Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.12 Ų, Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- has 1 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 Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-?
The CAS number of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- is 54313-83-6.
What is the molecular formula of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-?
The molecular formula of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- is C14H12BrNO.
What is the molecular weight of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-?
The molecular weight of Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- is 289.01 g/mol.
Where can I buy Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-?
You can request a quote for Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, 4-bromo-alpha-(2-(3-pyridinyl)ethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.