Bromopicrin
TL;DR: Bromopicrin (CAS 464-10-8) is a chemical compound with molecular formula CBr3NO2 and molecular weight 294.74792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tribromo(nitro)methane
Also Known As: Tribromonitromethane, Bromopicrin, Nitrobromoform, tribromo(nitro)methane, Nitrotribromomethane
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | CBr3NO2 |
| Molecular Weight | 294.74792 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.74588 Da |
| Heavy Atoms | 7 |
| Complexity | 79.0 |
| Melting Point | 50.4 °F (NTP, 1992) |
| Boiling Point | 192 to 194 °F at 20 mmHg (NTP, 1992) |
| Density | 2.793 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Vapor Pressure | 15 mmHg at 187 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 64 °F (NTP, 1992) |
| SMILES | C([N+](=O)[O-])(Br)(Br)Br |
| InChIKey | QQZIUHOKWDFXEY-UHFFFAOYSA-N |
Product Description
Applications: Bromopicrin is used in agrochemical development, including crop protection agent synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Bromopicrin is a agrochemical intermediate identified by CAS number 464-10-8 and the molecular formula CBr3NO2 and a molecular weight of 294.75 g/mol. Physically, the compound has a density of 2.793 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 64 °F (NTP, 1992). Synonyms include Tribromonitromethane and Bromopicrin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bromopicrin
Property Insights of Bromopicrin
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromopicrin. With a topological polar surface area (TPSA) of 45.8 Ų, Bromopicrin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromopicrin 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
What is the CAS number of Bromopicrin?
The CAS number of Bromopicrin is 464-10-8.
What is the molecular formula of Bromopicrin?
The molecular formula of Bromopicrin is CBr3NO2.
What is the molecular weight of Bromopicrin?
The molecular weight of Bromopicrin is 294.74792 g/mol.
What are the applications of Bromopicrin?
Bromopicrin is used in agrochemical development, including crop protection agent synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Bromopicrin?
You can request a quote for Bromopicrin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bromopicrin?
Yes, CoreyChem provides custom synthesis services for Bromopicrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.