2-Propenamide, 3-(4-bromophenyl)-2-cyano-
TL;DR: 2-Propenamide, 3-(4-bromophenyl)-2-cyano- (CAS 104127-29-9) is a chemical compound with molecular formula C10H7BrN2O and molecular weight 249.97418 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromophenyl)-2-cyanoprop-2-enamide
Also Known As: 3-(4-bromophenyl)-2-cyanoprop-2-enamide, 2-Propenamide, 3-(4-bromophenyl)-2-cyano-, (E)-3-(4-Bromophenyl)-2-cyanoacrylamide, (E)-3-(4-bromophenyl)-2-cyano-2-propenamide, 3-(4-bromophenyl)-2-cyano-2-Propenamide
Technical Specifications
| Molecular Formula | C10H7BrN2O |
| Molecular Weight | 249.97418 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.97418 Da |
| Heavy Atoms | 14 |
| Complexity | 294.0 |
| SMILES | C1=CC(=CC=C1C=C(C#N)C(=O)N)Br |
| InChIKey | JTTTWTYPKBLSRW-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propenamide, 3-(4-bromophenyl)-2-cyano-
Property Insights of 2-Propenamide, 3-(4-bromophenyl)-2-cyano-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenamide, 3-(4-bromophenyl)-2-cyano-. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenamide, 3-(4-bromophenyl)-2-cyano-. Following Lipinski's Rule of Five, 2-Propenamide, 3-(4-bromophenyl)-2-cyano- 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
What is the CAS number of 2-Propenamide, 3-(4-bromophenyl)-2-cyano-?
The CAS number of 2-Propenamide, 3-(4-bromophenyl)-2-cyano- is 104127-29-9.
What is the molecular formula of 2-Propenamide, 3-(4-bromophenyl)-2-cyano-?
The molecular formula of 2-Propenamide, 3-(4-bromophenyl)-2-cyano- is C10H7BrN2O.
What is the molecular weight of 2-Propenamide, 3-(4-bromophenyl)-2-cyano-?
The molecular weight of 2-Propenamide, 3-(4-bromophenyl)-2-cyano- is 249.97418 g/mol.
Where can I buy 2-Propenamide, 3-(4-bromophenyl)-2-cyano-?
You can request a quote for 2-Propenamide, 3-(4-bromophenyl)-2-cyano- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propenamide, 3-(4-bromophenyl)-2-cyano-?
Yes, CoreyChem provides custom synthesis services for 2-Propenamide, 3-(4-bromophenyl)-2-cyano- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.