![Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- structure](/static/products/2923/29238-14-0.webp)
Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-
TL;DR: Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- (CAS 29238-14-0) is a chemical compound with molecular formula C7H9NO2 and molecular weight 139.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hydroxybut-2-ynoxy)propanenitrile
Also Known As: 3-(4-hydroxybut-2-ynoxy)propanenitrile, Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-, 3-[(4-hydroxybut-2-yn-1-yl)oxy]propanenitrile
| Molecular Formula | C7H9NO2 |
|---|---|
| Molecular Weight | 139.06 g/mol |
| LogP | -0.08762 |
| Topological Polar Surface Area | 53.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 139.06332 |
| Heavy Atoms | 10 |
| Complexity | 160.67049 |
Chemical Identifiers
| CAS Number | 29238-14-0 |
|---|---|
| SMILES | C(COCC#CCO)C#N |
Product Overview
Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- (CAS 29238-14-0), with molecular formula C7H9NO2 and molecular weight 139.06 g/mol. IUPAC: 3-(4-hydroxybut-2-ynoxy)propanenitrile.
Chemical Property Profile of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-
Property Insights of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-
The XLogP value of -0.08762 indicates that Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.25 Ų, Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- 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 Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-?
The CAS number of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- is 29238-14-0.
What is the molecular formula of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-?
The molecular formula of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- is C7H9NO2.
What is the molecular weight of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-?
The molecular weight of Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- is 139.06 g/mol.
Where can I buy Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-?
You can request a quote for Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-[(4-hydroxy-2-butynyl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.