3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)
TL;DR: 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) (CAS 51171-86-9) is a chemical compound with molecular formula C28H31NO2 and molecular weight 413.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylcyclohex-3-en-1-amine;2-(4-phenylphenyl)butanoic acid
Also Known As: M.G. 6444, 4-Fenilcicloesen-(3)-ilammina sale con adfb, 4-Fenilcicloesen-(3)-ilammina sale con adfb [Italian], 4-Phenyl-3-cyclohexen-1-ylamine alpha-ethyl-4-biphenylacetate, 3-Cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)
| Molecular Formula | C28H31NO2 |
|---|---|
| Molecular Weight | 413.24 g/mol |
| LogP | 6.513 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.23547 |
| Heavy Atoms | 31 |
| Complexity | 978.54065 |
Chemical Identifiers
| CAS Number | 51171-86-9 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O.C1CC(=CCC1N)C2=CC=CC=C2 |
Product Overview
3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) (CAS 51171-86-9), with molecular formula C28H31NO2 and molecular weight 413.24 g/mol. IUPAC: 4-phenylcyclohex-3-en-1-amine;2-(4-phenylphenyl)butanoic acid.
Chemical Property Profile of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)
Property Insights of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)
The XLogP value of 6.513 indicates that 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt). Following Lipinski's Rule of Five, 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)?
The CAS number of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) is 51171-86-9.
What is the molecular formula of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)?
The molecular formula of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) is C28H31NO2.
What is the molecular weight of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)?
The molecular weight of 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) is 413.24 g/mol.
Where can I buy 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)?
You can request a quote for 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt)?
Yes, KEHONG BIO provides custom synthesis services for 3-cyclohexen-1-amine, 4-phenyl-, alpha-ethyl(1,1'-biphenyl)-4-acetate (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.