Alpha, beta-dibromocinnamic acid
TL;DR: Alpha, beta-dibromocinnamic acid (CAS 708-82-7) is a chemical compound with molecular formula C9H6Br2O2 and molecular weight 303.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2,3-dibromo-3-phenylprop-2-enoic acid
Also Known As: 2,3-Dibromo-3-phenyl-propenoic acid, AB-DIBROMOCINNAMICACID, I<<,EC-dibromo-cinnamic acid, A B-DIBROMOCINNAMIC ACID, -2,3-Dibromo-3-phenylpropenoicacid
| Molecular Formula | C9H6Br2O2 |
|---|---|
| Molecular Weight | 303.87 g/mol |
| LogP | 3.2296 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.87344 |
| Heavy Atoms | 13 |
| Complexity | 343.89215 |
Chemical Identifiers
| CAS Number | 708-82-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C(\C(=O)O)/Br)/Br |
Product Overview
Alpha, beta-dibromocinnamic acid (CAS 708-82-7), with molecular formula C9H6Br2O2 and molecular weight 303.87 g/mol. IUPAC: (Z)-2,3-dibromo-3-phenylprop-2-enoic acid.
Chemical Property Profile of Alpha, beta-dibromocinnamic acid
Property Insights of Alpha, beta-dibromocinnamic acid
The XLogP value of 3.2296 indicates that Alpha, beta-dibromocinnamic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Alpha, beta-dibromocinnamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha, beta-dibromocinnamic acid has 1 hydrogen bond donor(s) and 1 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 Alpha, beta-dibromocinnamic acid?
The CAS number of Alpha, beta-dibromocinnamic acid is 708-82-7.
What is the molecular formula of Alpha, beta-dibromocinnamic acid?
The molecular formula of Alpha, beta-dibromocinnamic acid is C9H6Br2O2.
What is the molecular weight of Alpha, beta-dibromocinnamic acid?
The molecular weight of Alpha, beta-dibromocinnamic acid is 303.87 g/mol.
Where can I buy Alpha, beta-dibromocinnamic acid?
You can request a quote for Alpha, beta-dibromocinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha, beta-dibromocinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for Alpha, beta-dibromocinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.