1-Bromo-1-chloro-1-nitroethane
TL;DR: 1-Bromo-1-chloro-1-nitroethane (CAS 26482-31-5) is a chemical compound with molecular formula C2H3BrClNO2 and molecular weight 186.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-1-chloro-1-nitroethane
Also Known As: 1-Bromo-1-chloro-1-nitroethane, bromo-chloronitroethane, 1-bromo-1-chloro-1-nitro-ethane, ETHANE, 1-BROMO-1-CHLORO-1-NITRO-, RefChem:1055010
| Molecular Formula | C2H3BrClNO2 |
|---|---|
| Molecular Weight | 186.90 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.90356 |
| Heavy Atoms | 7 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 26482-31-5 |
|---|---|
| SMILES | CC([N+](=O)[O-])(Cl)Br |
| InChIKey | JANZHGYIBPSXAE-UHFFFAOYSA-N |
Product Overview
1-Bromo-1-chloro-1-nitroethane (CAS 26482-31-5), with molecular formula C2H3BrClNO2 and molecular weight 186.90 g/mol. IUPAC: 1-bromo-1-chloro-1-nitroethane.
Chemical Property Profile of 1-Bromo-1-chloro-1-nitroethane
Property Insights of 1-Bromo-1-chloro-1-nitroethane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-1-chloro-1-nitroethane. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Bromo-1-chloro-1-nitroethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-1-chloro-1-nitroethane 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-Bromo-1-chloro-1-nitroethane?
The CAS number of 1-Bromo-1-chloro-1-nitroethane is 26482-31-5.
What is the molecular formula of 1-Bromo-1-chloro-1-nitroethane?
The molecular formula of 1-Bromo-1-chloro-1-nitroethane is C2H3BrClNO2.
What is the molecular weight of 1-Bromo-1-chloro-1-nitroethane?
The molecular weight of 1-Bromo-1-chloro-1-nitroethane is 186.90 g/mol.
Where can I buy 1-Bromo-1-chloro-1-nitroethane?
You can request a quote for 1-Bromo-1-chloro-1-nitroethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-1-chloro-1-nitroethane?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-1-chloro-1-nitroethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.