Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-
TL;DR: Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- (CAS 63867-27-6) is a chemical compound with molecular formula C8H16N2O and molecular weight 156.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(dimethylamino)-2-hydroxy-3,3-dimethylbutanenitrile
Also Known As: USAF A-4642, USAF A-1642, 4-(dimethylamino)-2-hydroxy-3,3-dimethylbutanenitrile, 2,2-Dimethyl-3-dimethylaminopropionaldehyde cyanohydrin, 3,3-Dimethyl-4-dimethylamino-2-hydroxybutyronitrile
Technical Specifications
| Molecular Formula | C8H16N2O |
| Molecular Weight | 156.12627 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 47.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.12627 Da |
| Heavy Atoms | 11 |
| Complexity | 166.0 |
| SMILES | CC(C)(CN(C)C)C(C#N)O |
| InChIKey | SIKJSEBSRRCVND-UHFFFAOYSA-N |
Chemical Property Profile of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-
Property Insights of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-. With a topological polar surface area (TPSA) of 47.3 Ų, Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- 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
What is the CAS number of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-?
The CAS number of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- is 63867-27-6.
What is the molecular formula of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-?
The molecular formula of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- is C8H16N2O.
What is the molecular weight of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-?
The molecular weight of Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- is 156.12627 g/mol.
Where can I buy Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-?
You can request a quote for Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy-?
Yes, CoreyChem provides custom synthesis services for Butyronitrile, 3,3-dimethyl-4-(dimethylamino)-2-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.