2-Heptenyl acetate, (2E)-
TL;DR: 2-Heptenyl acetate, (2E)- (CAS 1576-79-0) 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.
[(E)-hept-2-enyl] acetate
Also Known As: trans-2-Heptenyl acetate, 2-Heptenyl acetate, (E)-2-Heptenyl acetate, 2E-Heptenyl acetate, [(E)-hept-2-enyl] acetate
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 2.2959 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 127.52442 |
Chemical Identifiers
| CAS Number | 1576-79-0 |
|---|---|
| SMILES | CCCC/C=C/COC(=O)C |
Product Overview
2-Heptenyl acetate, (2E)- (CAS 1576-79-0), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: [(E)-hept-2-enyl] acetate.
Chemical Property Profile of 2-Heptenyl acetate, (2E)-
Property Insights of 2-Heptenyl acetate, (2E)-
The XLogP value of 2.2959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Heptenyl acetate, (2E)-. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Heptenyl acetate, (2E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptenyl acetate, (2E)- 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 2-Heptenyl acetate, (2E)-?
The CAS number of 2-Heptenyl acetate, (2E)- is 1576-79-0.
What is the molecular formula of 2-Heptenyl acetate, (2E)-?
The molecular formula of 2-Heptenyl acetate, (2E)- is C9H16O2.
What is the molecular weight of 2-Heptenyl acetate, (2E)-?
The molecular weight of 2-Heptenyl acetate, (2E)- is 156.12 g/mol.
Where can I buy 2-Heptenyl acetate, (2E)-?
You can request a quote for 2-Heptenyl acetate, (2E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptenyl acetate, (2E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptenyl acetate, (2E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.