2-Cyclopropylhexane
TL;DR: 2-Cyclopropylhexane (CAS 6976-28-9) is a chemical compound with molecular formula C9H18 and molecular weight 126.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexan-2-ylcyclopropane
Also Known As: 2-Cyclopropylhexane, hexan-2-ylcyclopropane, CYCLOPROPANE, 1-Methylpentyl cyclopropane, (1-METHYLPENTYL)CYCLOPROPANE
| Molecular Formula | C9H18 |
|---|---|
| Molecular Weight | 126.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 126.140854 |
| Heavy Atoms | 9 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 6976-28-9 |
|---|---|
| SMILES | CCCCC(C)C1CC1 |
| InChIKey | IYZQDBIQGSJSEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyclopropylhexane (CAS 6976-28-9), with molecular formula C9H18 and molecular weight 126.14 g/mol. IUPAC: hexan-2-ylcyclopropane.
Chemical Property Profile of 2-Cyclopropylhexane
Property Insights of 2-Cyclopropylhexane
The XLogP value of 4.3 indicates that 2-Cyclopropylhexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Cyclopropylhexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclopropylhexane has 0 hydrogen bond donor(s) and 0 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 2-Cyclopropylhexane?
The CAS number of 2-Cyclopropylhexane is 6976-28-9.
What is the molecular formula of 2-Cyclopropylhexane?
The molecular formula of 2-Cyclopropylhexane is C9H18.
What is the molecular weight of 2-Cyclopropylhexane?
The molecular weight of 2-Cyclopropylhexane is 126.14 g/mol.
Where can I buy 2-Cyclopropylhexane?
You can request a quote for 2-Cyclopropylhexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclopropylhexane?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclopropylhexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.