Aminocinnamonitrile
TL;DR: Aminocinnamonitrile (CAS 60375-56-6) is a chemical compound with molecular formula C9H8N2 and molecular weight 144.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-amino-3-phenylprop-2-enenitrile
Also Known As: Aminocinnamonitrile, 3-Amino-3-phenylacrylonitrile, 3-amino-3-phenylprop-2-enenitrile, 3-Aminocinnamonitrile, beta-Aminocinnamonitrile
| Molecular Formula | C9H8N2 |
|---|---|
| Molecular Weight | 144.07 g/mol |
| LogP | 1.50978 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.06874 |
| Heavy Atoms | 11 |
| Complexity | 293.0888 |
Chemical Identifiers
| CAS Number | 60375-56-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C/C#N)/N |
Product Overview
Aminocinnamonitrile (CAS 60375-56-6), with molecular formula C9H8N2 and molecular weight 144.07 g/mol. IUPAC: (Z)-3-amino-3-phenylprop-2-enenitrile.
Chemical Property Profile of Aminocinnamonitrile
Property Insights of Aminocinnamonitrile
The XLogP value of 1.50978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aminocinnamonitrile. With a topological polar surface area (TPSA) of 49.81 Ų, Aminocinnamonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aminocinnamonitrile has 1 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 Aminocinnamonitrile?
The CAS number of Aminocinnamonitrile is 60375-56-6.
What is the molecular formula of Aminocinnamonitrile?
The molecular formula of Aminocinnamonitrile is C9H8N2.
What is the molecular weight of Aminocinnamonitrile?
The molecular weight of Aminocinnamonitrile is 144.07 g/mol.
Where can I buy Aminocinnamonitrile?
You can request a quote for Aminocinnamonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aminocinnamonitrile?
Yes, KEHONG BIO provides custom synthesis services for Aminocinnamonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.