Hept-3-EN-1-yne
TL;DR: Hept-3-EN-1-yne (CAS 764-58-9) is a chemical compound with molecular formula C7H10 and molecular weight 94.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-hept-3-en-1-yne
Also Known As: 3-Heptene-1-yne, HEPT-3-EN-1-YNE, -3-Hepten-1-yne, (E)-hept-3-en-1-yne, (E)-3-Hepten-1-yne
| Molecular Formula | C7H10 |
|---|---|
| Molecular Weight | 94.08 g/mol |
| LogP | 1.9759 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 94.07825 |
| Heavy Atoms | 7 |
| Complexity | 82.70166 |
Chemical Identifiers
| CAS Number | 764-58-9 |
|---|---|
| SMILES | CCC/C=C/C#C |
Product Overview
Hept-3-EN-1-yne (CAS 764-58-9), with molecular formula C7H10 and molecular weight 94.08 g/mol. IUPAC: (E)-hept-3-en-1-yne.
Chemical Property Profile of Hept-3-EN-1-yne
Property Insights of Hept-3-EN-1-yne
The XLogP value of 1.9759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hept-3-EN-1-yne. With a topological polar surface area (TPSA) of 0.0 Ų, Hept-3-EN-1-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hept-3-EN-1-yne has 0 hydrogen bond donor(s) and 0 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 Hept-3-EN-1-yne?
The CAS number of Hept-3-EN-1-yne is 764-58-9.
What is the molecular formula of Hept-3-EN-1-yne?
The molecular formula of Hept-3-EN-1-yne is C7H10.
What is the molecular weight of Hept-3-EN-1-yne?
The molecular weight of Hept-3-EN-1-yne is 94.08 g/mol.
Where can I buy Hept-3-EN-1-yne?
You can request a quote for Hept-3-EN-1-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hept-3-EN-1-yne?
Yes, KEHONG BIO provides custom synthesis services for Hept-3-EN-1-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.