4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride
TL;DR: 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride (CAS 5424-09-9) is a chemical compound with molecular formula C21H27ClN2 and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylamino)-2,2-diphenylpentanenitrile;hydrochloride
Also Known As: WIN 1167, NIOSH/YV8245000, 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride, 4-(diethylamino)-2,2-diphenylpentanenitrile hydrochloride, Valeronitrile, 4-(diethylamino)-2,2-diphenyl-, hydrochloride
| Molecular Formula | C21H27ClN2 |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 5.03848 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 342.18628 |
| Heavy Atoms | 24 |
| Complexity | 590.39325 |
Chemical Identifiers
| CAS Number | 5424-09-9 |
|---|---|
| SMILES | CCN(CC)C(C)CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2.Cl |
Product Overview
4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride (CAS 5424-09-9), with molecular formula C21H27ClN2 and molecular weight 342.19 g/mol. IUPAC: 4-(diethylamino)-2,2-diphenylpentanenitrile;hydrochloride.
Chemical Property Profile of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride
Property Insights of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride
The XLogP value of 5.03848 indicates that 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.03 Ų, 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride?
The CAS number of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride is 5424-09-9.
What is the molecular formula of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride?
The molecular formula of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride is C21H27ClN2.
What is the molecular weight of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride?
The molecular weight of 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride is 342.19 g/mol.
Where can I buy 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride?
You can request a quote for 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(Diethylamino)-2,2-diphenylvaleronitrile hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.