1,3-Dichloro-3-methylbutane
TL;DR: 1,3-Dichloro-3-methylbutane (CAS 624-96-4) is a chemical compound with molecular formula C5H10Cl2 and molecular weight 140.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-3-methylbutane
Also Known As: 1,3-Dichloro-3-methylbutane, 1,3-Dichloro-3-methyl-butane, 2,4-Dichloro-2-methylbutane, Butane, 1,3-dichloro-3-methyl-, Butane,1,3-dichloro-3-methyl-
| Molecular Formula | C5H10Cl2 |
|---|---|
| Molecular Weight | 140.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.01596 |
| Heavy Atoms | 7 |
| Complexity | 50.0 |
Chemical Identifiers
| CAS Number | 624-96-4 |
|---|---|
| SMILES | CC(C)(CCCl)Cl |
| InChIKey | QGCOTJZDMVMLRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dichloro-3-methylbutane (CAS 624-96-4), with molecular formula C5H10Cl2 and molecular weight 140.02 g/mol. IUPAC: 1,3-dichloro-3-methylbutane.
Chemical Property Profile of 1,3-Dichloro-3-methylbutane
Property Insights of 1,3-Dichloro-3-methylbutane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dichloro-3-methylbutane. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Dichloro-3-methylbutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-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 1,3-Dichloro-3-methylbutane?
The CAS number of 1,3-Dichloro-3-methylbutane is 624-96-4.
What is the molecular formula of 1,3-Dichloro-3-methylbutane?
The molecular formula of 1,3-Dichloro-3-methylbutane is C5H10Cl2.
What is the molecular weight of 1,3-Dichloro-3-methylbutane?
The molecular weight of 1,3-Dichloro-3-methylbutane is 140.02 g/mol.
Where can I buy 1,3-Dichloro-3-methylbutane?
You can request a quote for 1,3-Dichloro-3-methylbutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dichloro-3-methylbutane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dichloro-3-methylbutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.