cis-3-Chloroallyl alcohol
TL;DR: cis-3-Chloroallyl alcohol (CAS 4643-05-4) is a chemical compound with molecular formula C3H5ClO and molecular weight 92.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-chloroprop-2-en-1-ol
Also Known As: cis-3-Chloroallyl alcohol, cis-3-Chloro-2-propene-1-ol, 3-Chloroallyl alcohol, (Z)-3-Chloroallyl alcohol, (2Z)-3-chloroprop-2-en-1-ol
| Molecular Formula | C3H5ClO |
|---|---|
| Molecular Weight | 92.00 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 92.00289 |
| Heavy Atoms | 5 |
| Complexity | 33.0 |
Chemical Identifiers
| CAS Number | 4643-05-4 |
|---|---|
| SMILES | C(/C=C\Cl)O |
| InChIKey | HJGHXDNIPAWLLE-UPHRSURJSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-3-Chloroallyl alcohol (CAS 4643-05-4), with molecular formula C3H5ClO and molecular weight 92.00 g/mol. IUPAC: (Z)-3-chloroprop-2-en-1-ol.
Chemical Property Profile of cis-3-Chloroallyl alcohol
Property Insights of cis-3-Chloroallyl alcohol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-3-Chloroallyl alcohol. With a topological polar surface area (TPSA) of 20.2 Ų, cis-3-Chloroallyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-3-Chloroallyl alcohol 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 cis-3-Chloroallyl alcohol?
The CAS number of cis-3-Chloroallyl alcohol is 4643-05-4.
What is the molecular formula of cis-3-Chloroallyl alcohol?
The molecular formula of cis-3-Chloroallyl alcohol is C3H5ClO.
What is the molecular weight of cis-3-Chloroallyl alcohol?
The molecular weight of cis-3-Chloroallyl alcohol is 92.00 g/mol.
Where can I buy cis-3-Chloroallyl alcohol?
You can request a quote for cis-3-Chloroallyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-3-Chloroallyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for cis-3-Chloroallyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.