3-癸氧基-2,2-二乙氧基丙腈
TL;DR: 3-癸氧基-2,2-二乙氧基丙腈 (CAS 70289-41-7) is a chemical compound with molecular formula C17H33NO3 and molecular weight 299.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-癸氧基-2,2-二乙氧基丙腈
3-[2-(2-decoxyethoxy)ethoxy]propanenitrile
Also Known As: Propionitrile, 3-decyloxy-2,2-diethoxyl-, 3-[2-(2-decoxyethoxy)ethoxy]propanenitrile, Propionitrile, 3-decyloxy-2,2-diethoxy/-,, 3-{2-[2-(Decyloxy)ethoxy]ethoxy}propanenitrile, RefChem:375258
| Molecular Formula | C17H33NO3 |
|---|---|
| Molecular Weight | 299.25 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 299.24603 |
| Heavy Atoms | 21 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 70289-41-7 |
|---|---|
| SMILES | CCCCCCCCCCOCCOCCOCCC#N |
| InChIKey | KTNQESBFWIQMRW-UHFFFAOYSA-N |
Product Overview
3-癸氧基-2,2-二乙氧基丙腈 (CAS 70289-41-7), with molecular formula C17H33NO3 and molecular weight 299.25 g/mol. IUPAC: 3-[2-(2-decoxyethoxy)ethoxy]propanenitrile.
Chemical Property Profile of 3-癸氧基-2,2-二乙氧基丙腈
Property Insights of 3-癸氧基-2,2-二乙氧基丙腈
The XLogP value of 4.0 indicates that 3-癸氧基-2,2-二乙氧基丙腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.5 Ų, 3-癸氧基-2,2-二乙氧基丙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-癸氧基-2,2-二乙氧基丙腈 has 0 hydrogen bond donor(s) and 4 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 3-癸氧基-2,2-二乙氧基丙腈?
The CAS number of 3-癸氧基-2,2-二乙氧基丙腈 is 70289-41-7.
What is the molecular formula of 3-癸氧基-2,2-二乙氧基丙腈?
The molecular formula of 3-癸氧基-2,2-二乙氧基丙腈 is C17H33NO3.
What is the molecular weight of 3-癸氧基-2,2-二乙氧基丙腈?
The molecular weight of 3-癸氧基-2,2-二乙氧基丙腈 is 299.25 g/mol.
Where can I buy 3-癸氧基-2,2-二乙氧基丙腈?
You can request a quote for 3-癸氧基-2,2-二乙氧基丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-癸氧基-2,2-二乙氧基丙腈?
Yes, KEHONG BIO provides custom synthesis services for 3-癸氧基-2,2-二乙氧基丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.