Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate
TL;DR: Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate (CAS 39647-01-3) is a chemical compound with molecular formula C6H8Br2O2 and molecular weight 269.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate
Also Known As: methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate, methyl 2,2-dibromo-1-methylcyclopropanecarboxylate, 1,1-dibromo-2-carbomethoxy-2-methylcyclopropane, methyl 2,2-dibromo-1-methyl-cyclopropanecarboxylate, methyl2,2-dibromo-1-methylcyclopropane-1-carboxylate
| Molecular Formula | C6H8Br2O2 |
|---|---|
| Molecular Weight | 269.89 g/mol |
| LogP | 2.0555 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.8891 |
| Heavy Atoms | 10 |
| Complexity | 178.58662 |
Chemical Identifiers
| CAS Number | 39647-01-3 |
|---|---|
| SMILES | CC1(CC1(Br)Br)C(=O)OC |
Product Overview
Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate (CAS 39647-01-3), with molecular formula C6H8Br2O2 and molecular weight 269.89 g/mol. IUPAC: methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate.
Chemical Property Profile of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate
Property Insights of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate
The XLogP value of 2.0555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate 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 Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate?
The CAS number of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate is 39647-01-3.
What is the molecular formula of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate?
The molecular formula of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate is C6H8Br2O2.
What is the molecular weight of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate?
The molecular weight of Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate is 269.89 g/mol.
Where can I buy Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate?
You can request a quote for Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,2-dibromo-1-methylcyclopropane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.