![Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- structure](/static/products/401/40127-71-7.png)
Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-
TL;DR: Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- (CAS 40127-71-7) is a chemical compound with molecular formula C10H20N2 and molecular weight 168.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,4-trimethylpentan-2-ylamino)acetonitrile
Also Known As: 2-(2,4,4-trimethylpentan-2-ylamino)acetonitrile, Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-
| Molecular Formula | C10H20N2 |
|---|---|
| Molecular Weight | 168.16 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.16264 |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 40127-71-7 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)NCC#N |
| InChIKey | DYOAJAJZOBDWKY-UHFFFAOYSA-N |
Product Overview
Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- (CAS 40127-71-7), with molecular formula C10H20N2 and molecular weight 168.16 g/mol. IUPAC: 2-(2,4,4-trimethylpentan-2-ylamino)acetonitrile.
Chemical Property Profile of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-
Property Insights of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-. With a topological polar surface area (TPSA) of 35.8 Ų, Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- has 1 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 Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-?
The CAS number of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- is 40127-71-7.
What is the molecular formula of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-?
The molecular formula of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- is C10H20N2.
What is the molecular weight of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-?
The molecular weight of Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- is 168.16 g/mol.
Where can I buy Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-?
You can request a quote for Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile, 2-[(1,1,3,3-tetramethylbutyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.