Heptyl Formate
TL;DR: Heptyl Formate (CAS 112-23-2) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
heptyl formate
Also Known As: Heptyl formate, Heptyl methanote, Heptanol, formate, n-Heptyl methanoate, Heptyl alcohol formate
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.11504 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 144.11504 Da |
| Heavy Atoms | 10 |
| Complexity | 71.0 |
| Boiling Point | 177.00 to 178.00 °C. @ 760.00 mm Hg |
| Density | 0.88277 (15°) |
| Refractive Index | 1.414 |
| Solubility | soluble in ether, most organic solvents; insoluble in water |
| SMILES | CCCCCCCOC=O |
| InChIKey | XEAMDSXSXYAICO-UHFFFAOYSA-N |
Product Description
Applications: Heptyl Formate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Heptyl Formate (CAS 112-23-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, Heptyl Formate (CAS 112-23-2) has the molecular formula C8H16O2 and a molecular weight of 144.12 g/mol. Reported properties include a density of 0.88277 (15°) g/cm³, a solubility: soluble in ether, most organic solvents; insoluble in water. It is also known as Heptyl formate and Heptyl methanote.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Heptyl Formate
Property Insights of Heptyl Formate
The XLogP value of 3.0 indicates that Heptyl Formate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Heptyl Formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl Formate 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
What is the CAS number of Heptyl Formate?
The CAS number of Heptyl Formate is 112-23-2.
What is the molecular formula of Heptyl Formate?
The molecular formula of Heptyl Formate is C8H16O2.
What is the molecular weight of Heptyl Formate?
The molecular weight of Heptyl Formate is 144.11504 g/mol.
What are the applications of Heptyl Formate?
Heptyl Formate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Heptyl Formate (CAS 112-23-2) with...
Where can I buy Heptyl Formate?
You can request a quote for Heptyl Formate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Heptyl Formate?
Yes, CoreyChem provides custom synthesis services for Heptyl Formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.