Cinnamaldehyde, beta-chloro-
TL;DR: Cinnamaldehyde, beta-chloro- (CAS 33603-87-1) 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)-3-chloro-3-phenylprop-2-enal
Also Known As: beta-Chlorocinnamaldehyde, (Z)-3-Chloro-3-phenylacrylaldehyde, CINNAMALDEHYDE, beta-CHLORO-, beta-Chlorobenzenepropenal, 3-chloro-3-phenylprop-2-enal
| 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 | 33603-87-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C/C=O)/Cl |
Product Overview
Cinnamaldehyde, beta-chloro- (CAS 33603-87-1), with molecular formula C9H7ClO and molecular weight 166.02 g/mol. IUPAC: (Z)-3-chloro-3-phenylprop-2-enal.
Chemical Property Profile of Cinnamaldehyde, beta-chloro-
Property Insights of Cinnamaldehyde, beta-chloro-
The XLogP value of 2.4652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinnamaldehyde, beta-chloro-. With a topological polar surface area (TPSA) of 17.07 Ų, Cinnamaldehyde, beta-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamaldehyde, beta-chloro- 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 Cinnamaldehyde, beta-chloro-?
The CAS number of Cinnamaldehyde, beta-chloro- is 33603-87-1.
What is the molecular formula of Cinnamaldehyde, beta-chloro-?
The molecular formula of Cinnamaldehyde, beta-chloro- is C9H7ClO.
What is the molecular weight of Cinnamaldehyde, beta-chloro-?
The molecular weight of Cinnamaldehyde, beta-chloro- is 166.02 g/mol.
Where can I buy Cinnamaldehyde, beta-chloro-?
You can request a quote for Cinnamaldehyde, beta-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamaldehyde, beta-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Cinnamaldehyde, beta-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.