3,3-Dimethoxy-2-(methoxymethyl)propanenitrile
TL;DR: 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile (CAS 1608-83-9) is a chemical compound with molecular formula C7H13NO3 and molecular weight 159.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethoxy-2-(methoxymethyl)propanenitrile
Also Known As: 3,3-dimethoxy-2-(methoxymethyl)propanenitrile, 2-Cyano-1,1,3-trimethoxypropane, alpha-Dimethoxymethyl-methoxypropionitrile, 2-Methoxymethyl-3,3-dimethoxypropiononitrile, Propanenitrile,3,3-dimethoxy-2-(methoxymethyl)-
| Molecular Formula | C7H13NO3 |
|---|---|
| Molecular Weight | 159.09 g/mol |
| LogP | 0.39148 |
| Topological Polar Surface Area | 51.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 159.08954 |
| Heavy Atoms | 11 |
| Complexity | 128.1376 |
Chemical Identifiers
| CAS Number | 1608-83-9 |
|---|---|
| SMILES | COCC(C#N)C(OC)OC |
Product Overview
3,3-Dimethoxy-2-(methoxymethyl)propanenitrile (CAS 1608-83-9), with molecular formula C7H13NO3 and molecular weight 159.09 g/mol. IUPAC: 3,3-dimethoxy-2-(methoxymethyl)propanenitrile.
Chemical Property Profile of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile
Property Insights of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile
The XLogP value of 0.39148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile. With a topological polar surface area (TPSA) of 51.48 Ų, 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile 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 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile?
The CAS number of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile is 1608-83-9.
What is the molecular formula of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile?
The molecular formula of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile is C7H13NO3.
What is the molecular weight of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile?
The molecular weight of 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile is 159.09 g/mol.
Where can I buy 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile?
You can request a quote for 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethoxy-2-(methoxymethyl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.