2-Dimethylaminomethylacrylonitrile
TL;DR: 2-Dimethylaminomethylacrylonitrile (CAS 26728-79-0) is a chemical compound with molecular formula C6H10N2 and molecular weight 110.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(dimethylamino)methyl]prop-2-enenitrile
Also Known As: 2-Dimethylaminomethylacrylonitrile, 2-Dimethylaminomethylpropenenitrile, 2-(dimethylaminomethyl)prop-2-enenitrile, 2-[(dimethylamino)methyl]-2-propenenitrile, 2-[(N,N-dimethylamino)methyl]-2-propenenitrile
| Molecular Formula | C6H10N2 |
|---|---|
| Molecular Weight | 110.08 g/mol |
| LogP | 0.62778 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.0844 |
| Heavy Atoms | 8 |
| Complexity | 118.98045 |
Chemical Identifiers
| CAS Number | 26728-79-0 |
|---|---|
| SMILES | CN(C)CC(=C)C#N |
Product Overview
2-Dimethylaminomethylacrylonitrile (CAS 26728-79-0), with molecular formula C6H10N2 and molecular weight 110.08 g/mol. IUPAC: 2-[(dimethylamino)methyl]prop-2-enenitrile.
Chemical Property Profile of 2-Dimethylaminomethylacrylonitrile
Property Insights of 2-Dimethylaminomethylacrylonitrile
The XLogP value of 0.62778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Dimethylaminomethylacrylonitrile. With a topological polar surface area (TPSA) of 27.03 Ų, 2-Dimethylaminomethylacrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Dimethylaminomethylacrylonitrile has 0 hydrogen bond donor(s) and 2 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 2-Dimethylaminomethylacrylonitrile?
The CAS number of 2-Dimethylaminomethylacrylonitrile is 26728-79-0.
What is the molecular formula of 2-Dimethylaminomethylacrylonitrile?
The molecular formula of 2-Dimethylaminomethylacrylonitrile is C6H10N2.
What is the molecular weight of 2-Dimethylaminomethylacrylonitrile?
The molecular weight of 2-Dimethylaminomethylacrylonitrile is 110.08 g/mol.
Where can I buy 2-Dimethylaminomethylacrylonitrile?
You can request a quote for 2-Dimethylaminomethylacrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Dimethylaminomethylacrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Dimethylaminomethylacrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.