Butanoic acid, 2-hexenyl ester, (Z)-
TL;DR: Butanoic acid, 2-hexenyl ester, (Z)- (CAS 56922-77-1) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-hex-2-enyl] butanoate
Also Known As: (z)-2-hexenyl butyrate, (2Z)-2-Hexenyl butyrate #, [(Z)-hex-2-enyl] butanoate, Butyric acid (Z)-2-hexenyl ester, Butanoic acid, 2-hexenyl ester, (Z)-
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.686 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 138.774 |
Chemical Identifiers
| CAS Number | 56922-77-1 |
|---|---|
| SMILES | CCC/C=C\COC(=O)CCC |
Product Overview
Butanoic acid, 2-hexenyl ester, (Z)- (CAS 56922-77-1), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: [(Z)-hex-2-enyl] butanoate.
Chemical Property Profile of Butanoic acid, 2-hexenyl ester, (Z)-
Property Insights of Butanoic acid, 2-hexenyl ester, (Z)-
The XLogP value of 2.686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 2-hexenyl ester, (Z)-. With a topological polar surface area (TPSA) of 26.3 Ų, Butanoic acid, 2-hexenyl ester, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, 2-hexenyl ester, (Z)- 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 Butanoic acid, 2-hexenyl ester, (Z)-?
The CAS number of Butanoic acid, 2-hexenyl ester, (Z)- is 56922-77-1.
What is the molecular formula of Butanoic acid, 2-hexenyl ester, (Z)-?
The molecular formula of Butanoic acid, 2-hexenyl ester, (Z)- is C10H18O2.
What is the molecular weight of Butanoic acid, 2-hexenyl ester, (Z)-?
The molecular weight of Butanoic acid, 2-hexenyl ester, (Z)- is 170.13 g/mol.
Where can I buy Butanoic acid, 2-hexenyl ester, (Z)-?
You can request a quote for Butanoic acid, 2-hexenyl ester, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 2-hexenyl ester, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 2-hexenyl ester, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.