Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-
TL;DR: Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- (CAS 14780-15-5) is a chemical compound with molecular formula C15H21ClN2 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-2-[2-(dimethylamino)ethyl]-3-methylbutanenitrile
Also Known As: 2-(p-Chlorophenyl)-4-(dimethylamino)-2-isopropylbutyronitrile, BUTYRONITRILE, 2-(p-CHLOROPHENYL)-4-(DIMETHYLAMINO)-2-ISOPROPYL-, 2-(4-chlorophenyl)-2-(2-dimethylaminoethyl)-3-methylbutanenitrile, 2-(4-chlorophenyl)-2-[2-(dimethylamino)ethyl]-3-methylbutanenitrile, BRN 2124100
| Molecular Formula | C15H21ClN2 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.1393 |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 14780-15-5 |
|---|---|
| SMILES | CC(C)C(CCN(C)C)(C#N)C1=CC=C(C=C1)Cl |
| InChIKey | GDQFGXLOZMECLM-UHFFFAOYSA-N |
Product Overview
Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- (CAS 14780-15-5), with molecular formula C15H21ClN2 and molecular weight 264.14 g/mol. IUPAC: 2-(4-chlorophenyl)-2-[2-(dimethylamino)ethyl]-3-methylbutanenitrile.
Chemical Property Profile of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-
Property Insights of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-
The XLogP value of 3.8 indicates that Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- has 0 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 Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-?
The CAS number of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- is 14780-15-5.
What is the molecular formula of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-?
The molecular formula of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- is C15H21ClN2.
What is the molecular weight of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-?
The molecular weight of Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- is 264.14 g/mol.
Where can I buy Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-?
You can request a quote for Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl-?
Yes, KEHONG BIO provides custom synthesis services for Butyronitrile, 2-(p-chlorophenyl)-4-(dimethylamino)-2-isopropyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.