Bromodichloronitromethane
TL;DR: Bromodichloronitromethane (CAS 918-01-4) is a chemical compound with molecular formula CBrCl2NO2 and molecular weight 206.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bromo-dichloro-nitromethane
Also Known As: Bromodichloronitromethane, Dichlorobromonitromethane, bromo-dichloro-nitromethane, Methane, bromodichloronitro-, BDCNM
| Molecular Formula | CBrCl2NO2 |
|---|---|
| Molecular Weight | 206.85 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.84895 |
| Heavy Atoms | 7 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 918-01-4 |
|---|---|
| SMILES | C([N+](=O)[O-])(Cl)(Cl)Br |
| InChIKey | JMZWGJLCNQYBHT-UHFFFAOYSA-N |
Product Overview
Bromodichloronitromethane (CAS 918-01-4), with molecular formula CBrCl2NO2 and molecular weight 206.85 g/mol. IUPAC: bromo-dichloro-nitromethane.
Chemical Property Profile of Bromodichloronitromethane
Property Insights of Bromodichloronitromethane
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromodichloronitromethane. With a topological polar surface area (TPSA) of 45.8 Ų, Bromodichloronitromethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromodichloronitromethane 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 Bromodichloronitromethane?
The CAS number of Bromodichloronitromethane is 918-01-4.
What is the molecular formula of Bromodichloronitromethane?
The molecular formula of Bromodichloronitromethane is CBrCl2NO2.
What is the molecular weight of Bromodichloronitromethane?
The molecular weight of Bromodichloronitromethane is 206.85 g/mol.
Where can I buy Bromodichloronitromethane?
You can request a quote for Bromodichloronitromethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromodichloronitromethane?
Yes, KEHONG BIO provides custom synthesis services for Bromodichloronitromethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.