(1-Methylbutyl)cyclopropane
TL;DR: (1-Methylbutyl)cyclopropane (CAS 5458-16-2) is a chemical compound with molecular formula C8H16 and molecular weight 112.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentan-2-ylcyclopropane
Also Known As: 1-Methylbutylcyclopropane, Pentane, 2-cyclopropyl-, (1-METHYLBUTYL)CYCLOPROPANE, pentan-2-ylcyclopropane, CYCLOPROPANE
| Molecular Formula | C8H16 |
|---|---|
| Molecular Weight | 112.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.1252 |
| Heavy Atoms | 8 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 5458-16-2 |
|---|---|
| SMILES | CCCC(C)C1CC1 |
| InChIKey | HDRPKFBKHPJRQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1-Methylbutyl)cyclopropane (CAS 5458-16-2), with molecular formula C8H16 and molecular weight 112.13 g/mol. IUPAC: pentan-2-ylcyclopropane.
Chemical Property Profile of (1-Methylbutyl)cyclopropane
Property Insights of (1-Methylbutyl)cyclopropane
The XLogP value of 3.8 indicates that (1-Methylbutyl)cyclopropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (1-Methylbutyl)cyclopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methylbutyl)cyclopropane 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 (1-Methylbutyl)cyclopropane?
The CAS number of (1-Methylbutyl)cyclopropane is 5458-16-2.
What is the molecular formula of (1-Methylbutyl)cyclopropane?
The molecular formula of (1-Methylbutyl)cyclopropane is C8H16.
What is the molecular weight of (1-Methylbutyl)cyclopropane?
The molecular weight of (1-Methylbutyl)cyclopropane is 112.13 g/mol.
Where can I buy (1-Methylbutyl)cyclopropane?
You can request a quote for (1-Methylbutyl)cyclopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methylbutyl)cyclopropane?
Yes, KEHONG BIO provides custom synthesis services for (1-Methylbutyl)cyclopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.