1-Heptanamine
TL;DR: 1-Heptanamine (CAS 111-68-2) is a chemical compound with molecular formula C7H17N and molecular weight 115.1361 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
heptan-1-amine
Also Known As: Heptylamine, 1-Aminoheptane, heptan-1-amine, 1-Heptanamine, N-HEPTYLAMINE
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H17N |
| Molecular Weight | 115.1361 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 115.1361 Da |
| Heavy Atoms | 8 |
| Complexity | 35.0 |
| SMILES | CCCCCCCN |
| InChIKey | WJYIASZWHGOTOU-UHFFFAOYSA-N |
Product Description
Applications: 1-Heptanamine 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 1-Heptanamine (CAS 111-68-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1-Heptanamine is a heterocyclic building block identified by CAS number 111-68-2 and the molecular formula C7H17N and a molecular weight of 115.14 g/mol. It is also known as Heptylamine and 1-Aminoheptane.
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 1-Heptanamine
Property Insights of 1-Heptanamine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Heptanamine. With a topological polar surface area (TPSA) of 26.0 Ų, 1-Heptanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Heptanamine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Heptanamine?
The CAS number of 1-Heptanamine is 111-68-2.
What is the molecular formula of 1-Heptanamine?
The molecular formula of 1-Heptanamine is C7H17N.
What is the molecular weight of 1-Heptanamine?
The molecular weight of 1-Heptanamine is 115.1361 g/mol.
What are the applications of 1-Heptanamine?
1-Heptanamine 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 1-Heptanamine (CAS 111-68-2) with custom...
Where can I buy 1-Heptanamine?
You can request a quote for 1-Heptanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Heptanamine?
Yes, CoreyChem provides custom synthesis services for 1-Heptanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.