Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-
TL;DR: Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- (CAS 89333-13-1) is a chemical compound with molecular formula C9H7ClO2 and molecular weight 182.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(4-chlorophenyl)-3-hydroxyprop-2-enal
Also Known As: 2-(4-Chlorophenyl)-3-hydroxypropenal, 2-(4-chlorophenyl)-3-hydroxyprop-2-enal, (2Z)-2-(4-chlorophenyl)-3-hydroxyprop-2-enal, J2.340.249A, (Z)-2-(4-chlorophenyl)-3-hydroxyprop-2-enal
| Molecular Formula | C9H7ClO2 |
|---|---|
| Molecular Weight | 182.01 g/mol |
| LogP | 2.4378 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.01346 |
| Heavy Atoms | 12 |
| Complexity | 300.8095 |
Chemical Identifiers
| CAS Number | 89333-13-1 |
|---|---|
| SMILES | C1=CC(=CC=C1/C(=C/O)/C=O)Cl |
Product Overview
Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- (CAS 89333-13-1), with molecular formula C9H7ClO2 and molecular weight 182.01 g/mol. IUPAC: (Z)-2-(4-chlorophenyl)-3-hydroxyprop-2-enal.
Chemical Property Profile of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-
Property Insights of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-
The XLogP value of 2.4378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-. With a topological polar surface area (TPSA) of 37.3 Ų, Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- 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 Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-?
The CAS number of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- is 89333-13-1.
What is the molecular formula of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-?
The molecular formula of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- is C9H7ClO2.
What is the molecular weight of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-?
The molecular weight of Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- is 182.01 g/mol.
Where can I buy Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-?
You can request a quote for Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetaldehyde, 4-chloro-alpha-(hydroxymethylene)-, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.