2,2-Dichlorocyclopropane-1-carbonitrile
TL;DR: 2,2-Dichlorocyclopropane-1-carbonitrile (CAS 3712-82-1) is a chemical compound with molecular formula C4H3Cl2N and molecular weight 134.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichlorocyclopropane-1-carbonitrile
Also Known As: 2,2-dichlorocyclopropane-1-carbonitrile, 2,2-Dichlorocyclopropanecarbonitrile, sOxDFHaQBSWxuUp@, 1,1-Dichloro-2-cyanocyclopropane, Cyclopropanecarbonitrile,2,2-dichloro-
| Molecular Formula | C4H3Cl2N |
|---|---|
| Molecular Weight | 134.96 g/mol |
| LogP | 1.70378 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.96425 |
| Heavy Atoms | 7 |
| Complexity | 124.14171 |
Chemical Identifiers
| CAS Number | 3712-82-1 |
|---|---|
| SMILES | C1C(C1(Cl)Cl)C#N |
Product Overview
2,2-Dichlorocyclopropane-1-carbonitrile (CAS 3712-82-1), with molecular formula C4H3Cl2N and molecular weight 134.96 g/mol. IUPAC: 2,2-dichlorocyclopropane-1-carbonitrile.
Chemical Property Profile of 2,2-Dichlorocyclopropane-1-carbonitrile
Property Insights of 2,2-Dichlorocyclopropane-1-carbonitrile
The XLogP value of 1.70378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dichlorocyclopropane-1-carbonitrile. With a topological polar surface area (TPSA) of 23.79 Ų, 2,2-Dichlorocyclopropane-1-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dichlorocyclopropane-1-carbonitrile has 0 hydrogen bond donor(s) and 1 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 2,2-Dichlorocyclopropane-1-carbonitrile?
The CAS number of 2,2-Dichlorocyclopropane-1-carbonitrile is 3712-82-1.
What is the molecular formula of 2,2-Dichlorocyclopropane-1-carbonitrile?
The molecular formula of 2,2-Dichlorocyclopropane-1-carbonitrile is C4H3Cl2N.
What is the molecular weight of 2,2-Dichlorocyclopropane-1-carbonitrile?
The molecular weight of 2,2-Dichlorocyclopropane-1-carbonitrile is 134.96 g/mol.
Where can I buy 2,2-Dichlorocyclopropane-1-carbonitrile?
You can request a quote for 2,2-Dichlorocyclopropane-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dichlorocyclopropane-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dichlorocyclopropane-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.