alpha-Chlorocinnamaldehyde
TL;DR: alpha-Chlorocinnamaldehyde (CAS 33603-89-3) is a chemical compound with molecular formula C9H7ClO and molecular weight 166.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-chloro-3-phenylprop-2-enal
Also Known As: alpha-Chlorocinnamaldehyde, 2-Chloro-3-phenylacrylaldehyde, A-Chlorocinnamaldehyde, 2-Propenal, 2-chloro-3-phenyl-, 2-Chlorocinnamaldehyde
| Molecular Formula | C9H7ClO |
|---|---|
| Molecular Weight | 166.02 g/mol |
| LogP | 2.4652 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.01854 |
| Heavy Atoms | 11 |
| Complexity | 264.15103 |
Chemical Identifiers
| CAS Number | 33603-89-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(/C=O)\Cl |
Product Overview
alpha-Chlorocinnamaldehyde (CAS 33603-89-3), with molecular formula C9H7ClO and molecular weight 166.02 g/mol. IUPAC: (Z)-2-chloro-3-phenylprop-2-enal.
Chemical Property Profile of alpha-Chlorocinnamaldehyde
Property Insights of alpha-Chlorocinnamaldehyde
The XLogP value of 2.4652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Chlorocinnamaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, alpha-Chlorocinnamaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Chlorocinnamaldehyde has 0 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-Chlorocinnamaldehyde?
The CAS number of alpha-Chlorocinnamaldehyde is 33603-89-3.
What is the molecular formula of alpha-Chlorocinnamaldehyde?
The molecular formula of alpha-Chlorocinnamaldehyde is C9H7ClO.
What is the molecular weight of alpha-Chlorocinnamaldehyde?
The molecular weight of alpha-Chlorocinnamaldehyde is 166.02 g/mol.
Where can I buy alpha-Chlorocinnamaldehyde?
You can request a quote for alpha-Chlorocinnamaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Chlorocinnamaldehyde?
Yes, KEHONG BIO provides custom synthesis services for alpha-Chlorocinnamaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.