Butyl bromide
TL;DR: Butyl bromide (CAS 109-65-9) is a chemical compound with molecular formula C4H9Br and molecular weight 135.98875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromobutane
Also Known As: 1-Bromobutane, Butyl bromide, N-BUTYL BROMIDE, Bromobutane, n-Butylbromide
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H9Br |
| Molecular Weight | 135.98875 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 135.98875 Da |
| Heavy Atoms | 5 |
| Complexity | 13.0 |
| Melting Point | -170 °F (USCG, 1999) |
| Boiling Point | 214 °F at 760 mmHg (USCG, 1999) |
| Density | 1.276 at 68 °F (USCG, 1999) - Denser than water; will sink |
| Flash Point | 65 °F (USCG, 1999) |
| Vapor Pressure | 77.55 mmHg (USCG, 1999) |
| Refractive Index | Index of refraction = 1.4398 at 20 °C/D |
| Solubility | Slightly soluble in carbon tetrachloride; soluble in chloroform; miscible with ethanol, ether, acetone |
| SMILES | CCCCBr |
| InChIKey | MPPPKRYCTPRNTB-UHFFFAOYSA-N |
Product Description
Applications: Butyl bromide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butyl bromide (CAS 109-65-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Butyl bromide is a heterocyclic building block identified by CAS number 109-65-9 and the molecular formula C4H9Br and a molecular weight of 135.99 g/mol. Physically, the compound has a density of 1.276 at 68 °F (USCG, 1999) - Denser than water; will sink g/cm³, a solubility: Slightly soluble in carbon tetrachloride; soluble in chloroform; miscible with ethanol, ether, acetone. It is also known as 1-Bromobutane and Butyl bromide.
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 Butyl bromide
Property Insights of Butyl bromide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl bromide. With a topological polar surface area (TPSA) of 0.0 Ų, Butyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl bromide has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butyl bromide?
The CAS number of Butyl bromide is 109-65-9.
What is the molecular formula of Butyl bromide?
The molecular formula of Butyl bromide is C4H9Br.
What is the molecular weight of Butyl bromide?
The molecular weight of Butyl bromide is 135.98875 g/mol.
What are the applications of Butyl bromide?
Butyl bromide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butyl bromide (CAS 109-65-9) with custom...
Where can I buy Butyl bromide?
You can request a quote for Butyl bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyl bromide?
Yes, CoreyChem provides custom synthesis services for Butyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.