3,3-二乙氧基丙腈
TL;DR: 3,3-二乙氧基丙腈 (CAS 2032-34-0) is a chemical compound with molecular formula C7H13NO2 and molecular weight 143.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-二乙氧基丙腈
3,3-diethoxypropanenitrile
Also Known As: 3,3-Diethoxypropanenitrile, 3,3-Diethoxypropionitrile, Propanenitrile, 3,3-diethoxy-, cyadea, 3,3-Diethoxypropiononitrile
| Molecular Formula | C7H13NO2 |
|---|---|
| Molecular Weight | 143.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 143.09464 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 2032-34-0 |
|---|---|
| SMILES | CCOC(CC#N)OCC |
| InChIKey | WBOXEOCWOCJQNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3-二乙氧基丙腈 (CAS 2032-34-0), with molecular formula C7H13NO2 and molecular weight 143.09 g/mol. IUPAC: 3,3-diethoxypropanenitrile.
Chemical Property Profile of 3,3-二乙氧基丙腈
Property Insights of 3,3-二乙氧基丙腈
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-二乙氧基丙腈. With a topological polar surface area (TPSA) of 42.3 Ų, 3,3-二乙氧基丙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-二乙氧基丙腈 has 0 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 3,3-二乙氧基丙腈?
The CAS number of 3,3-二乙氧基丙腈 is 2032-34-0.
What is the molecular formula of 3,3-二乙氧基丙腈?
The molecular formula of 3,3-二乙氧基丙腈 is C7H13NO2.
What is the molecular weight of 3,3-二乙氧基丙腈?
The molecular weight of 3,3-二乙氧基丙腈 is 143.09 g/mol.
Where can I buy 3,3-二乙氧基丙腈?
You can request a quote for 3,3-二乙氧基丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-二乙氧基丙腈?
Yes, KEHONG BIO provides custom synthesis services for 3,3-二乙氧基丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.