2-Chloro-3-methylbutane
TL;DR: 2-Chloro-3-methylbutane (CAS 631-65-2) is a chemical compound with molecular formula C5H11Cl and molecular weight 106.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-methylbutane
Also Known As: 2-Chloro-3-methylbutane, Butane, 2-chloro-3-methyl-, 2-Chloro-3-methylbutane., 2-chloro-3-methyl-butane, 2-Methylbut-3-ylchlorid
| Molecular Formula | C5H11Cl |
|---|---|
| Molecular Weight | 106.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 106.05493 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
Chemical Identifiers
| CAS Number | 631-65-2 |
|---|---|
| SMILES | CC(C)C(C)Cl |
| InChIKey | JMTRCXPSDMMAGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-3-methylbutane (CAS 631-65-2), with molecular formula C5H11Cl and molecular weight 106.05 g/mol. IUPAC: 2-chloro-3-methylbutane.
Chemical Property Profile of 2-Chloro-3-methylbutane
Property Insights of 2-Chloro-3-methylbutane
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-3-methylbutane. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Chloro-3-methylbutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-methylbutane 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-Chloro-3-methylbutane?
The CAS number of 2-Chloro-3-methylbutane is 631-65-2.
What is the molecular formula of 2-Chloro-3-methylbutane?
The molecular formula of 2-Chloro-3-methylbutane is C5H11Cl.
What is the molecular weight of 2-Chloro-3-methylbutane?
The molecular weight of 2-Chloro-3-methylbutane is 106.05 g/mol.
Where can I buy 2-Chloro-3-methylbutane?
You can request a quote for 2-Chloro-3-methylbutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-3-methylbutane?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3-methylbutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.