Hex-3-en-1-yl formate
TL;DR: Hex-3-en-1-yl formate (CAS 33467-73-1) 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-3-enyl formate
Also Known As: cis-3-Hexenyl formate, Hex-3-enyl formate, HEX-3-EN-1-YL FORMATE, cis-3-HEXENYLFORMATE, 3-Hexen-1-ol, 1-formate
| Molecular Formula | C7H12O2 |
|---|---|
| Molecular Weight | 128.08 g/mol |
| LogP | 1.9 |
| 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 | 33467-73-1 |
|---|---|
| SMILES | CCC=CCCOC=O |
| InChIKey | XJHQVZQZUGLZLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hex-3-en-1-yl formate (CAS 33467-73-1), with molecular formula C7H12O2 and molecular weight 128.08 g/mol. IUPAC: hex-3-enyl formate.
Chemical Property Profile of Hex-3-en-1-yl formate
Property Insights of Hex-3-en-1-yl formate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hex-3-en-1-yl formate. With a topological polar surface area (TPSA) of 26.3 Ų, Hex-3-en-1-yl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hex-3-en-1-yl 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-3-en-1-yl formate?
The CAS number of Hex-3-en-1-yl formate is 33467-73-1.
What is the molecular formula of Hex-3-en-1-yl formate?
The molecular formula of Hex-3-en-1-yl formate is C7H12O2.
What is the molecular weight of Hex-3-en-1-yl formate?
The molecular weight of Hex-3-en-1-yl formate is 128.08 g/mol.
Where can I buy Hex-3-en-1-yl formate?
You can request a quote for Hex-3-en-1-yl formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hex-3-en-1-yl formate?
Yes, KEHONG BIO provides custom synthesis services for Hex-3-en-1-yl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.