2-Chlorohexanal
TL;DR: 2-Chlorohexanal (CAS 762-39-0) is a chemical compound with molecular formula C6H11ClO and molecular weight 134.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chlorohexanal
Also Known As: 2-Chlorohexanal, Hexanal, 2-chloro-, alpha-chlorohexanal, 2-Chloro-hexanal, 2-Chlorohexanal #
| Molecular Formula | C6H11ClO |
|---|---|
| Molecular Weight | 134.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 134.04984 |
| Heavy Atoms | 8 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 762-39-0 |
|---|---|
| SMILES | CCCCC(C=O)Cl |
| InChIKey | WSMIPVGUPYXHDT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chlorohexanal (CAS 762-39-0), with molecular formula C6H11ClO and molecular weight 134.05 g/mol. IUPAC: 2-chlorohexanal.
Chemical Property Profile of 2-Chlorohexanal
Property Insights of 2-Chlorohexanal
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlorohexanal. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Chlorohexanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorohexanal 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 2-Chlorohexanal?
The CAS number of 2-Chlorohexanal is 762-39-0.
What is the molecular formula of 2-Chlorohexanal?
The molecular formula of 2-Chlorohexanal is C6H11ClO.
What is the molecular weight of 2-Chlorohexanal?
The molecular weight of 2-Chlorohexanal is 134.05 g/mol.
Where can I buy 2-Chlorohexanal?
You can request a quote for 2-Chlorohexanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorohexanal?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorohexanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.