cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid
TL;DR: cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid (CAS 85603-41-4) is a chemical compound with molecular formula C14H15BrO3 and molecular weight 310.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,2S)-2-(4-bromobenzoyl)cyclohexane-1-carboxylic acid
Also Known As: cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid, cis-2-(4-Bromobenzoyl)cyclohexanecarboxylicacid, CIS-2-(4-BROMOBENZOYL)-1-CYCLOHEXANE-CARBOXYLIC ACID, (1R,2S)-2-(4-bromobenzoyl)cyclohexane-1-carboxylic acid, cis-2-(4-bromobenzoyl)-1-cyclohexanecarboxylic acid
| Molecular Formula | C14H15BrO3 |
|---|---|
| Molecular Weight | 310.02 g/mol |
| LogP | 3.5228 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.02045 |
| Heavy Atoms | 18 |
| Complexity | 452.61185 |
Chemical Identifiers
| CAS Number | 85603-41-4 |
|---|---|
| SMILES | C1CC[C@H]([C@H](C1)C(=O)C2=CC=C(C=C2)Br)C(=O)O |
Product Overview
cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid (CAS 85603-41-4), with molecular formula C14H15BrO3 and molecular weight 310.02 g/mol. IUPAC: cis-(1R,2S)-2-(4-bromobenzoyl)cyclohexane-1-carboxylic acid.
Chemical Property Profile of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid
Property Insights of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid
The XLogP value of 3.5228 indicates that cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid has 1 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 cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid?
The CAS number of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid is 85603-41-4.
What is the molecular formula of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid?
The molecular formula of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid is C14H15BrO3.
What is the molecular weight of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid?
The molecular weight of cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid is 310.02 g/mol.
Where can I buy cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid?
You can request a quote for cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for cis-2-(4-Bromobenzoyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.