(2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile
TL;DR: (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile (CAS 70205-70-8) is a chemical compound with molecular formula C11H12N2 and molecular weight 172.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-(dimethylamino)-2-phenylprop-2-enenitrile
Also Known As: 3-(dimethylamino)-2-phenylacrylonitrile, (2z)-3-(dimethylamino)-2-phenylprop-2-enenitrile, dimethylaminophenylacrylonitrile, (beta-Cyanostyryl)dimethylamine, KST-1A2188
| Molecular Formula | C11H12N2 |
|---|---|
| Molecular Weight | 172.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.10005 |
| Heavy Atoms | 13 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 70205-70-8 |
|---|---|
| SMILES | CN(C)/C=C(\C#N)/C1=CC=CC=C1 |
| InChIKey | VDKZGONUAHUVJF-PKNBQFBNSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile (CAS 70205-70-8), with molecular formula C11H12N2 and molecular weight 172.10 g/mol. IUPAC: (Z)-3-(dimethylamino)-2-phenylprop-2-enenitrile.
Chemical Property Profile of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile
Property Insights of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile. With a topological polar surface area (TPSA) of 27.0 Ų, (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile 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 (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile?
The CAS number of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile is 70205-70-8.
What is the molecular formula of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile?
The molecular formula of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile is C11H12N2.
What is the molecular weight of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile?
The molecular weight of (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile is 172.10 g/mol.
Where can I buy (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile?
You can request a quote for (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2z)-3-(Dimethylamino)-2-phenylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.