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(Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate
TL;DR: (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate (CAS 61898-25-7) is a chemical compound with molecular formula C10H13BrO2 and molecular weight 244.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bicyclo[2.2.1]hept-5-enylmethyl 2-bromoacetate
Also Known As: 5-bicyclo[2.2.1]hept-2-enylmethyl 2-bromoacetate, 3-dichloroacetyl-2-dichloromethyl-oxazolidine, bicyclo[2.2.1]hept-5-en-2-ylmethyl bromoacetate, J3.597.025H, (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate
| Molecular Formula | C10H13BrO2 |
|---|---|
| Molecular Weight | 244.01 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.00989 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 61898-25-7 |
|---|---|
| SMILES | C1C2CC(C1C=C2)COC(=O)CBr |
| InChIKey | YMUCCFYCQVTQAP-UHFFFAOYSA-N |
Product Overview
(Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate (CAS 61898-25-7), with molecular formula C10H13BrO2 and molecular weight 244.01 g/mol. IUPAC: 2-bicyclo[2.2.1]hept-5-enylmethyl 2-bromoacetate.
Chemical Property Profile of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate
Property Insights of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate. With a topological polar surface area (TPSA) of 26.3 Ų, (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate 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 (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate?
The CAS number of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate is 61898-25-7.
What is the molecular formula of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate?
The molecular formula of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate is C10H13BrO2.
What is the molecular weight of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate?
The molecular weight of (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate is 244.01 g/mol.
Where can I buy (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate?
You can request a quote for (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate?
Yes, KEHONG BIO provides custom synthesis services for (Bicyclo[2.2.1]hept-5-en-2-yl)methyl bromoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.