1,1-Dichloro-2,2-dimethylcyclopropane
TL;DR: 1,1-Dichloro-2,2-dimethylcyclopropane (CAS 694-16-6) is a chemical compound with molecular formula C5H8Cl2 and molecular weight 138.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dichloro-2,2-dimethylcyclopropane
Also Known As: 1,1-Dichloro-2,2-dimethylcyclopropane, Cyclopropane, 1,1-dichloro-2,2-dimethyl-, 2,2-Dichloro-1,1-dimethylcyclopropane, 1,1-dichloro-2,2-dimethyl-cyclopropane
| Molecular Formula | C5H8Cl2 |
|---|---|
| Molecular Weight | 138.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.0003 |
| Heavy Atoms | 7 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 694-16-6 |
|---|---|
| SMILES | CC1(CC1(Cl)Cl)C |
| InChIKey | NNBWTSXEHTTWMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Dichloro-2,2-dimethylcyclopropane (CAS 694-16-6), with molecular formula C5H8Cl2 and molecular weight 138.00 g/mol. IUPAC: 1,1-dichloro-2,2-dimethylcyclopropane.
Chemical Property Profile of 1,1-Dichloro-2,2-dimethylcyclopropane
Property Insights of 1,1-Dichloro-2,2-dimethylcyclopropane
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dichloro-2,2-dimethylcyclopropane. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1-Dichloro-2,2-dimethylcyclopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dichloro-2,2-dimethylcyclopropane 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 1,1-Dichloro-2,2-dimethylcyclopropane?
The CAS number of 1,1-Dichloro-2,2-dimethylcyclopropane is 694-16-6.
What is the molecular formula of 1,1-Dichloro-2,2-dimethylcyclopropane?
The molecular formula of 1,1-Dichloro-2,2-dimethylcyclopropane is C5H8Cl2.
What is the molecular weight of 1,1-Dichloro-2,2-dimethylcyclopropane?
The molecular weight of 1,1-Dichloro-2,2-dimethylcyclopropane is 138.00 g/mol.
Where can I buy 1,1-Dichloro-2,2-dimethylcyclopropane?
You can request a quote for 1,1-Dichloro-2,2-dimethylcyclopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dichloro-2,2-dimethylcyclopropane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dichloro-2,2-dimethylcyclopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.