4-(Prop-2-en-1-yloxy)benzoic acid
TL;DR: 4-(Prop-2-en-1-yloxy)benzoic acid (CAS 27914-60-9) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-prop-2-enoxybenzoic acid
Also Known As: 4-(allyloxy)benzoic acid, 4-Allyloxy-benzoic acid, 4-Allyloxybenzoic acid, 4-prop-2-enoxybenzoic acid, 4-(prop-2-en-1-yloxy)benzoic acid
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 27914-60-9 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)C(=O)O |
| InChIKey | DYDWKSVZHZNBLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Prop-2-en-1-yloxy)benzoic acid (CAS 27914-60-9), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: 4-prop-2-enoxybenzoic acid.
Chemical Property Profile of 4-(Prop-2-en-1-yloxy)benzoic acid
Property Insights of 4-(Prop-2-en-1-yloxy)benzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Prop-2-en-1-yloxy)benzoic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-(Prop-2-en-1-yloxy)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Prop-2-en-1-yloxy)benzoic acid has 1 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 4-(Prop-2-en-1-yloxy)benzoic acid?
The CAS number of 4-(Prop-2-en-1-yloxy)benzoic acid is 27914-60-9.
What is the molecular formula of 4-(Prop-2-en-1-yloxy)benzoic acid?
The molecular formula of 4-(Prop-2-en-1-yloxy)benzoic acid is C10H10O3.
What is the molecular weight of 4-(Prop-2-en-1-yloxy)benzoic acid?
The molecular weight of 4-(Prop-2-en-1-yloxy)benzoic acid is 178.06 g/mol.
Where can I buy 4-(Prop-2-en-1-yloxy)benzoic acid?
You can request a quote for 4-(Prop-2-en-1-yloxy)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-(Prop-2-en-1-yloxy)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Prop-2-en-1-yloxy)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.