Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)
TL;DR: Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) (CAS 3468-32-4) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyclohexylphenyl) pyridine-3-carboxylate
Also Known As: p-Cyclohexylphenyl nicotinate, 4-Cyclohexylphenyl nicotinate, 4-Cyclohexylphenyl 3-pyridinecarboxylate, 4-cyclohexyl-phenyl nicotinate, P-CYCLOHEXYLPHENYLNICOTINATE
| Molecular Formula | C18H19NO2 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.14157 |
| Heavy Atoms | 21 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 3468-32-4 |
|---|---|
| SMILES | C1CCC(CC1)C2=CC=C(C=C2)OC(=O)C3=CN=CC=C3 |
| InChIKey | WZPVEPWPLQMODU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) (CAS 3468-32-4), with molecular formula C18H19NO2 and molecular weight 281.14 g/mol. IUPAC: (4-cyclohexylphenyl) pyridine-3-carboxylate.
Chemical Property Profile of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)
Property Insights of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)
The XLogP value of 4.8 indicates that Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) has 0 hydrogen bond donor(s) and 3 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 Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)?
The CAS number of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) is 3468-32-4.
What is the molecular formula of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)?
The molecular formula of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) is C18H19NO2.
What is the molecular weight of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)?
The molecular weight of Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) is 281.14 g/mol.
Where can I buy Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)?
You can request a quote for Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI)?
Yes, KEHONG BIO provides custom synthesis services for Nicotinic acid, p-cyclohexylphenyl ester (7CI,8CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.