4-(Cyclohex-1-en-1-yl)benzoic acid
TL;DR: 4-(Cyclohex-1-en-1-yl)benzoic acid (CAS 74980-13-5) is a chemical compound with molecular formula C13H14O2 and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(cyclohexen-1-yl)benzoic acid
Also Known As: 4-(cyclohex-1-en-1-yl)benzoic acid, 4-(1-cyclohexenyl)benzoic acid, 4-(cyclohexen-1-yl)benzoic acid, 4-cyclohex-1-enyl-benzoic acid, p-(1-cyclohexenyl)-benzoic acid
| Molecular Formula | C13H14O2 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.09938 |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 74980-13-5 |
|---|---|
| SMILES | C1CCC(=CC1)C2=CC=C(C=C2)C(=O)O |
| InChIKey | CVGYWJHGWOZOMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Cyclohex-1-en-1-yl)benzoic acid (CAS 74980-13-5), with molecular formula C13H14O2 and molecular weight 202.10 g/mol. IUPAC: 4-(cyclohexen-1-yl)benzoic acid.
Chemical Property Profile of 4-(Cyclohex-1-en-1-yl)benzoic acid
Property Insights of 4-(Cyclohex-1-en-1-yl)benzoic acid
The XLogP value of 4.1 indicates that 4-(Cyclohex-1-en-1-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(Cyclohex-1-en-1-yl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Cyclohex-1-en-1-yl)benzoic 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 4-(Cyclohex-1-en-1-yl)benzoic acid?
The CAS number of 4-(Cyclohex-1-en-1-yl)benzoic acid is 74980-13-5.
What is the molecular formula of 4-(Cyclohex-1-en-1-yl)benzoic acid?
The molecular formula of 4-(Cyclohex-1-en-1-yl)benzoic acid is C13H14O2.
What is the molecular weight of 4-(Cyclohex-1-en-1-yl)benzoic acid?
The molecular weight of 4-(Cyclohex-1-en-1-yl)benzoic acid is 202.10 g/mol.
Where can I buy 4-(Cyclohex-1-en-1-yl)benzoic acid?
You can request a quote for 4-(Cyclohex-1-en-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Cyclohex-1-en-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Cyclohex-1-en-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.