2-Heptanol
TL;DR: 2-Heptanol (CAS 543-49-7) is a chemical compound with molecular formula C7H16O and molecular weight 116.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
heptan-2-ol
Also Known As: 2-HEPTANOL, Heptan-2-ol, s-Heptyl alcohol, 2-Heptyl alcohol, 2-Hydroxyheptane
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H16O |
| Molecular Weight | 116.12012 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 116.12012 Da |
| Heavy Atoms | 8 |
| Complexity | 43.0 |
| Boiling Point | 158-160 °C |
| Density | Relative density (water = 1): 0.82 |
| Flash Point | 160 °F (NFPA, 2010) |
| Vapor Pressure | 1.23 [mmHg] |
| Refractive Index | 1.421-1.422 |
| Solubility | Solubility in water, g/100ml: 0.35 |
| SMILES | CCCCCC(C)O |
| InChIKey | CETWDUZRCINIHU-UHFFFAOYSA-N |
Product Description
Applications: 2-Heptanol is used in complex organic molecule assembly across discovery and process chemistry, as well as specialty chemical manufacturing and formulation. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A organic building block supplied by CoreyChem, 2-Heptanol (CAS 543-49-7) has the molecular formula C7H16O and a molecular weight of 116.12 g/mol. Reported properties include a density of Relative density (water = 1): 0.82 g/cm³, a solubility: Solubility in water, g/100ml: 0.35. Synonyms include 2-HEPTANOL and Heptan-2-ol.
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 2-Heptanol
Property Insights of 2-Heptanol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Heptanol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Heptanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptanol 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 2-Heptanol?
The CAS number of 2-Heptanol is 543-49-7.
What is the molecular formula of 2-Heptanol?
The molecular formula of 2-Heptanol is C7H16O.
What is the molecular weight of 2-Heptanol?
The molecular weight of 2-Heptanol is 116.12012 g/mol.
What are the applications of 2-Heptanol?
2-Heptanol is used in complex organic molecule assembly across discovery and process chemistry, as well as specialty chemical manufacturing and formulation. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...
Where can I buy 2-Heptanol?
You can request a quote for 2-Heptanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Heptanol?
Yes, CoreyChem provides custom synthesis services for 2-Heptanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.