2-Bromo-2-cycloundecenyl camphanate
TL;DR: 2-Bromo-2-cycloundecenyl camphanate (CAS 112927-19-2) is a chemical compound with molecular formula C21H31BrO4 and molecular weight 426.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2E)-2-bromocycloundec-2-en-1-yl] (1R,4S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Also Known As: BCUC, 2-Bromo-2-cycloundecenyl camphanate, Cycloundecane,2-oxabicyclo[2.2.1]heptane-1-carboxylic acid deriv., [(2E)-2-bromocycloundec-2-en-1-yl] (1R,4S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate, (2-bromocycloundec-2-en-1-yl) 4,7,7-trimethylbicyclo[2.2.1]heptane-3-carboxylate
| Molecular Formula | C21H31BrO4 |
|---|---|
| Molecular Weight | 426.14 g/mol |
| LogP | 5.4333 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 426.14056 |
| Heavy Atoms | 26 |
| Complexity | 611.1323 |
Chemical Identifiers
| CAS Number | 112927-19-2 |
|---|---|
| SMILES | C[C@]12CC[C@](C1(C)C)(OC2=O)C(=O)OC/3CCCCCCCC/C=C3/Br |
Product Overview
2-Bromo-2-cycloundecenyl camphanate (CAS 112927-19-2), with molecular formula C21H31BrO4 and molecular weight 426.14 g/mol. IUPAC: [(2E)-2-bromocycloundec-2-en-1-yl] (1R,4S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate.
Chemical Property Profile of 2-Bromo-2-cycloundecenyl camphanate
Property Insights of 2-Bromo-2-cycloundecenyl camphanate
The XLogP value of 5.4333 indicates that 2-Bromo-2-cycloundecenyl camphanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Bromo-2-cycloundecenyl camphanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-2-cycloundecenyl camphanate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromo-2-cycloundecenyl camphanate?
The CAS number of 2-Bromo-2-cycloundecenyl camphanate is 112927-19-2.
What is the molecular formula of 2-Bromo-2-cycloundecenyl camphanate?
The molecular formula of 2-Bromo-2-cycloundecenyl camphanate is C21H31BrO4.
What is the molecular weight of 2-Bromo-2-cycloundecenyl camphanate?
The molecular weight of 2-Bromo-2-cycloundecenyl camphanate is 426.14 g/mol.
Where can I buy 2-Bromo-2-cycloundecenyl camphanate?
You can request a quote for 2-Bromo-2-cycloundecenyl camphanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-2-cycloundecenyl camphanate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-2-cycloundecenyl camphanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.