1-Chloro-2,2-dimethylbutane
TL;DR: 1-Chloro-2,2-dimethylbutane (CAS 6366-35-4) is a chemical compound with molecular formula C6H13Cl and molecular weight 120.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2,2-dimethylbutane
Also Known As: 1-Chloro-2,2-dimethylbutane, Butane, 1-chloro-2,2-dimethyl, 1-chloro-2,2-dimethyl-butane, Butane, 1-chloro-2,2-dimethyl-, Butane,1-chloro-2,2-dimethyl
| Molecular Formula | C6H13Cl |
|---|---|
| Molecular Weight | 120.07 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 | 120.07058 |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 6366-35-4 |
|---|---|
| SMILES | CCC(C)(C)CCl |
| InChIKey | JRUIYWSZTLWHME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-2,2-dimethylbutane (CAS 6366-35-4), with molecular formula C6H13Cl and molecular weight 120.07 g/mol. IUPAC: 1-chloro-2,2-dimethylbutane.
Chemical Property Profile of 1-Chloro-2,2-dimethylbutane
Property Insights of 1-Chloro-2,2-dimethylbutane
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-2,2-dimethylbutane. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-2,2-dimethylbutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-2,2-dimethylbutane 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-Chloro-2,2-dimethylbutane?
The CAS number of 1-Chloro-2,2-dimethylbutane is 6366-35-4.
What is the molecular formula of 1-Chloro-2,2-dimethylbutane?
The molecular formula of 1-Chloro-2,2-dimethylbutane is C6H13Cl.
What is the molecular weight of 1-Chloro-2,2-dimethylbutane?
The molecular weight of 1-Chloro-2,2-dimethylbutane is 120.07 g/mol.
Where can I buy 1-Chloro-2,2-dimethylbutane?
You can request a quote for 1-Chloro-2,2-dimethylbutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-2,2-dimethylbutane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-2,2-dimethylbutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.