1-Bromo-2-methyl-1-propene
TL;DR: 1-Bromo-2-methyl-1-propene (CAS 3017-69-4) is a chemical compound with molecular formula C4H7Br and molecular weight 133.97311 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-2-methylprop-1-ene
Also Known As: 1-Bromo-2-methyl-1-propene, 1-bromo-2-methylprop-1-ene, 1-Bromo-2-methylpropene, Isocrotyl bromide, Isobutylenbromid
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H7Br |
| Molecular Weight | 133.97311 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 133.97311 Da |
| Heavy Atoms | 5 |
| Complexity | 41.0 |
| SMILES | CC(=CBr)C |
| InChIKey | DEFNUDNHTUZJAL-UHFFFAOYSA-N |
Chemical Property Profile of 1-Bromo-2-methyl-1-propene
Property Insights of 1-Bromo-2-methyl-1-propene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-2-methyl-1-propene. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Bromo-2-methyl-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-methyl-1-propene 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 1-Bromo-2-methyl-1-propene?
The CAS number of 1-Bromo-2-methyl-1-propene is 3017-69-4.
What is the molecular formula of 1-Bromo-2-methyl-1-propene?
The molecular formula of 1-Bromo-2-methyl-1-propene is C4H7Br.
What is the molecular weight of 1-Bromo-2-methyl-1-propene?
The molecular weight of 1-Bromo-2-methyl-1-propene is 133.97311 g/mol.
Where can I buy 1-Bromo-2-methyl-1-propene?
You can request a quote for 1-Bromo-2-methyl-1-propene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Bromo-2-methyl-1-propene?
Yes, CoreyChem provides custom synthesis services for 1-Bromo-2-methyl-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.