Hex-3-en-1-yl propanoate
TL;DR: Hex-3-en-1-yl propanoate (CAS 33467-74-2) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hex-3-enyl propanoate
Also Known As: cis-3-Hexenyl propionate, hex-3-enyl propanoate, 3-hexenyl propanoate, (Z)-Hex-3-en-1-yl propionate, hex-3-en-1-ol,propanoic acid
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 33467-74-2 |
|---|---|
| SMILES | CCC=CCCOC(=O)CC |
| InChIKey | LGTLDEUQCOJGFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hex-3-en-1-yl propanoate (CAS 33467-74-2), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: hex-3-enyl propanoate.
Chemical Property Profile of Hex-3-en-1-yl propanoate
Property Insights of Hex-3-en-1-yl propanoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hex-3-en-1-yl propanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Hex-3-en-1-yl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hex-3-en-1-yl propanoate 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 propanoate?
The CAS number of Hex-3-en-1-yl propanoate is 33467-74-2.
What is the molecular formula of Hex-3-en-1-yl propanoate?
The molecular formula of Hex-3-en-1-yl propanoate is C9H16O2.
What is the molecular weight of Hex-3-en-1-yl propanoate?
The molecular weight of Hex-3-en-1-yl propanoate is 156.12 g/mol.
Where can I buy Hex-3-en-1-yl propanoate?
You can request a quote for Hex-3-en-1-yl propanoate 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 propanoate?
Yes, KEHONG BIO provides custom synthesis services for Hex-3-en-1-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.