1,1-Dichloro-1-nitrosoethane
TL;DR: 1,1-Dichloro-1-nitrosoethane (CAS 677-23-6) is a chemical compound with molecular formula C2H3Cl2NO and molecular weight 126.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dichloro-1-nitrosoethane
Also Known As: Ethane, 1,1-dichloro-1-nitroso-, 1,1-dichloro-1-nitrosoethane, 1-Nitroso-1,1-dichloroethane, RefChem:1051751
| Molecular Formula | C2H3Cl2NO |
|---|---|
| Molecular Weight | 126.96 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.95917 |
| Heavy Atoms | 6 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 677-23-6 |
|---|---|
| SMILES | CC(N=O)(Cl)Cl |
| InChIKey | FALBQWHGTLHCLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Dichloro-1-nitrosoethane (CAS 677-23-6), with molecular formula C2H3Cl2NO and molecular weight 126.96 g/mol. IUPAC: 1,1-dichloro-1-nitrosoethane.
Chemical Property Profile of 1,1-Dichloro-1-nitrosoethane
Property Insights of 1,1-Dichloro-1-nitrosoethane
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dichloro-1-nitrosoethane. With a topological polar surface area (TPSA) of 29.4 Ų, 1,1-Dichloro-1-nitrosoethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dichloro-1-nitrosoethane has 0 hydrogen bond donor(s) and 2 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-1-nitrosoethane?
The CAS number of 1,1-Dichloro-1-nitrosoethane is 677-23-6.
What is the molecular formula of 1,1-Dichloro-1-nitrosoethane?
The molecular formula of 1,1-Dichloro-1-nitrosoethane is C2H3Cl2NO.
What is the molecular weight of 1,1-Dichloro-1-nitrosoethane?
The molecular weight of 1,1-Dichloro-1-nitrosoethane is 126.96 g/mol.
Where can I buy 1,1-Dichloro-1-nitrosoethane?
You can request a quote for 1,1-Dichloro-1-nitrosoethane 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-1-nitrosoethane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dichloro-1-nitrosoethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.