![Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- structure](/static/products/6842/68426-03-9.webp)
Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-
TL;DR: Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- (CAS 68426-03-9) is a chemical compound with molecular formula C12H25N3 and molecular weight 211.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-amino-2,4,4-trimethylhexyl)amino]propanenitrile
Also Known As: 3-[ amino]propiononitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]propanenitrile, Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-, N1-(2-Cyanoethyl)-2,4,4-trimethylhexane-1,6-diamine, Propanenitrile, 3-((6-amino-2,4,4-trimethylhexyl)amino)-
| Molecular Formula | C12H25N3 |
|---|---|
| Molecular Weight | 211.20 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 211.20485 |
| Heavy Atoms | 15 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 68426-03-9 |
|---|---|
| SMILES | CC(CC(C)(C)CCN)CNCCC#N |
| InChIKey | KMSHUCQEMCGTFX-UHFFFAOYSA-N |
Product Overview
Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- (CAS 68426-03-9), with molecular formula C12H25N3 and molecular weight 211.20 g/mol. IUPAC: 3-[(6-amino-2,4,4-trimethylhexyl)amino]propanenitrile.
Chemical Property Profile of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-
Property Insights of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-. Following Lipinski's Rule of Five, Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- has 2 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 Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-?
The CAS number of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- is 68426-03-9.
What is the molecular formula of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-?
The molecular formula of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- is C12H25N3.
What is the molecular weight of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-?
The molecular weight of Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- is 211.20 g/mol.
Where can I buy Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-?
You can request a quote for Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-[(6-amino-2,4,4-trimethylhexyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.