2-Ethyl-1-butene
TL;DR: 2-Ethyl-1-butene (CAS 760-21-4) is a chemical compound with molecular formula C6H12 and molecular weight 84.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylidenepentane
Also Known As: 2-ETHYL-1-BUTENE, 3-Methylenepentane, 3-methylidenepentane, 2-Ethylbut-1-ene, Pentane, 3-methylene-
| Molecular Formula | C6H12 |
|---|---|
| Molecular Weight | 84.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 84.0939 |
| Heavy Atoms | 6 |
| Complexity | 38.0 |
| Vapor Pressure | 175.0 [mmHg] |
Chemical Identifiers
| CAS Number | 760-21-4 |
|---|---|
| SMILES | CCC(=C)CC |
| InChIKey | RYKZRKKEYSRDNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyl-1-butene (CAS 760-21-4), with molecular formula C6H12 and molecular weight 84.09 g/mol. IUPAC: 3-methylidenepentane.
Chemical Property Profile of 2-Ethyl-1-butene
Property Insights of 2-Ethyl-1-butene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-1-butene. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Ethyl-1-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-1-butene 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-Ethyl-1-butene?
The CAS number of 2-Ethyl-1-butene is 760-21-4.
What is the molecular formula of 2-Ethyl-1-butene?
The molecular formula of 2-Ethyl-1-butene is C6H12.
What is the molecular weight of 2-Ethyl-1-butene?
The molecular weight of 2-Ethyl-1-butene is 84.09 g/mol.
Where can I buy 2-Ethyl-1-butene?
You can request a quote for 2-Ethyl-1-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-1-butene?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-1-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.