4-(Prop-2-yn-1-yloxy)butanoic acid
TL;DR: 4-(Prop-2-yn-1-yloxy)butanoic acid (CAS 500595-98-2) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-prop-2-ynoxybutanoic acid
Also Known As: NCIStruc1_001794, NCIStruc2_000225, 4-prop-2-ynoxybutanoic acid, 4-(prop-2-yn-1-yloxy)butanoic acid, 4-(2-propynyloxy)butanoic acid
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 500595-98-2 |
|---|---|
| SMILES | C#CCOCCCC(=O)O |
| InChIKey | UJYCTVUDPGXFLI-UHFFFAOYSA-N |
Product Overview
4-(Prop-2-yn-1-yloxy)butanoic acid (CAS 500595-98-2), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: 4-prop-2-ynoxybutanoic acid.
Chemical Property Profile of 4-(Prop-2-yn-1-yloxy)butanoic acid
Property Insights of 4-(Prop-2-yn-1-yloxy)butanoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Prop-2-yn-1-yloxy)butanoic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-(Prop-2-yn-1-yloxy)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Prop-2-yn-1-yloxy)butanoic 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-yn-1-yloxy)butanoic acid?
The CAS number of 4-(Prop-2-yn-1-yloxy)butanoic acid is 500595-98-2.
What is the molecular formula of 4-(Prop-2-yn-1-yloxy)butanoic acid?
The molecular formula of 4-(Prop-2-yn-1-yloxy)butanoic acid is C7H10O3.
What is the molecular weight of 4-(Prop-2-yn-1-yloxy)butanoic acid?
The molecular weight of 4-(Prop-2-yn-1-yloxy)butanoic acid is 142.06 g/mol.
Where can I buy 4-(Prop-2-yn-1-yloxy)butanoic acid?
You can request a quote for 4-(Prop-2-yn-1-yloxy)butanoic 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-yn-1-yloxy)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Prop-2-yn-1-yloxy)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.