Hex-2-enyl formate
TL;DR: Hex-2-enyl formate (CAS 53398-78-0) is a chemical compound with molecular formula C7H12O2 and molecular weight 128.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hex-2-enyl formate
Also Known As: Hex-2-enyl formate, (E)-2-hexen-1-yl formate, 2-Hexen-1-ol, formate, (2E)-, RefChem:784345
| Molecular Formula | C7H12O2 |
|---|---|
| Molecular Weight | 128.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 128.08372 |
| Heavy Atoms | 9 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 53398-78-0 |
|---|---|
| SMILES | CCCC=CCOC=O |
| InChIKey | SLWYMCAVYPZTRN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hex-2-enyl formate (CAS 53398-78-0), with molecular formula C7H12O2 and molecular weight 128.08 g/mol. IUPAC: hex-2-enyl formate.
Chemical Property Profile of Hex-2-enyl formate
Property Insights of Hex-2-enyl formate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hex-2-enyl formate. With a topological polar surface area (TPSA) of 26.3 Ų, Hex-2-enyl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hex-2-enyl formate has 0 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 Hex-2-enyl formate?
The CAS number of Hex-2-enyl formate is 53398-78-0.
What is the molecular formula of Hex-2-enyl formate?
The molecular formula of Hex-2-enyl formate is C7H12O2.
What is the molecular weight of Hex-2-enyl formate?
The molecular weight of Hex-2-enyl formate is 128.08 g/mol.
Where can I buy Hex-2-enyl formate?
You can request a quote for Hex-2-enyl formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hex-2-enyl formate?
Yes, KEHONG BIO provides custom synthesis services for Hex-2-enyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.