EINECS 300-496-1
TL;DR: EINECS 300-496-1 (CAS 93940-97-7) is a chemical compound with molecular formula C16H28N4 and molecular weight 276.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(2-cyanoethylamino)-1,3,3-trimethylcyclohexyl]methylamino]propanenitrile
Also Known As: EINECS 300-496-1, 3-[[3-[[(2-CYANOETHYL)AMINO]METHYL]-3,5,5-TRIMETHYLCYCLOHEXYL]AMINO]PROPIONONITRILE, 3-[[5-(2-cyanoethylamino)-1,3,3-trimethylcyclohexyl]methylamino]propanenitrile, 3-((3-(((2-Cyanoethyl)amino)methyl)-3,5,5-trimethylcyclohexyl)amino)propiononitrile, Propanenitrile, 3-((3-(((2-cyanoethyl)amino)methyl)-3,5,5-trimethylcyclohexyl)amino)-
| Molecular Formula | C16H28N4 |
|---|---|
| Molecular Weight | 276.23 g/mol |
| LogP | 2.57796 |
| Topological Polar Surface Area | 71.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 276.23138 |
| Heavy Atoms | 20 |
| Complexity | 376.91855 |
Chemical Identifiers
| CAS Number | 93940-97-7 |
|---|---|
| SMILES | CC1(CC(CC(C1)(C)CNCCC#N)NCCC#N)C |
Product Overview
EINECS 300-496-1 (CAS 93940-97-7), with molecular formula C16H28N4 and molecular weight 276.23 g/mol. IUPAC: 3-[[5-(2-cyanoethylamino)-1,3,3-trimethylcyclohexyl]methylamino]propanenitrile.
Chemical Property Profile of EINECS 300-496-1
Property Insights of EINECS 300-496-1
The XLogP value of 2.57796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 300-496-1. The TPSA of 71.64 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 300-496-1. Following Lipinski's Rule of Five, EINECS 300-496-1 has 2 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 EINECS 300-496-1?
The CAS number of EINECS 300-496-1 is 93940-97-7.
What is the molecular formula of EINECS 300-496-1?
The molecular formula of EINECS 300-496-1 is C16H28N4.
What is the molecular weight of EINECS 300-496-1?
The molecular weight of EINECS 300-496-1 is 276.23 g/mol.
Where can I buy EINECS 300-496-1?
You can request a quote for EINECS 300-496-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 300-496-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 300-496-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.