Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
TL;DR: Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester (CAS 73019-15-5) is a chemical compound with molecular formula C17H30O2 and molecular weight 266.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2E)-3,7-dimethylocta-2,6-dienyl] heptanoate
Also Known As: Geranyl heptanoate, Neryl heptanoate, geranyl-n-heptanoate, [(2E)-3,7-dimethylocta-2,6-dienyl] heptanoate, (E)-3,7-Dimethyl-2,6-octadienyl heptanoate
| Molecular Formula | C17H30O2 |
|---|---|
| Molecular Weight | 266.22 g/mol |
| LogP | 5.1927 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 266.22458 |
| Heavy Atoms | 19 |
| Complexity | 296.3839 |
Chemical Identifiers
| CAS Number | 73019-15-5 |
|---|---|
| SMILES | CCCCCCC(=O)OC/C=C(\C)/CCC=C(C)C |
Product Overview
Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester (CAS 73019-15-5), with molecular formula C17H30O2 and molecular weight 266.22 g/mol. IUPAC: [(2E)-3,7-dimethylocta-2,6-dienyl] heptanoate.
Chemical Property Profile of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
Property Insights of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
The XLogP value of 5.1927 indicates that Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester?
The CAS number of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester is 73019-15-5.
What is the molecular formula of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester?
The molecular formula of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester is C17H30O2.
What is the molecular weight of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester?
The molecular weight of Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester is 266.22 g/mol.
Where can I buy Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester?
You can request a quote for Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Heptanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.