TL;DR: Formamide, N-(2-bromoallyl)- (CAS 101398-39-4) is a chemical compound with molecular formula C4H6BrNO and molecular weight 162.96329 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-bromoprop-2-enyl)formamide
Also Known As: N-(2-Bromoallyl)formamide, FORMAMIDE, N-(2-BROMOALLYL)-, N-(2-bromoprop-2-enyl)formamide, n-(2-bromoprop-2-en-1-yl)formamide
| Molecular Formula | C4H6BrNO |
| Molecular Weight | 162.96329 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.96329 Da |
| Heavy Atoms | 7 |
| Complexity | 81.0 |
| SMILES | C=C(CNC=O)Br |
| InChIKey | HIMDUOONNQPZHJ-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Formamide, N-(2-bromoallyl)-. With a topological polar surface area (TPSA) of 29.1 Ų, Formamide, N-(2-bromoallyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Formamide, N-(2-bromoallyl)- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Formamide, N-(2-bromoallyl)- is 101398-39-4.
The molecular formula of Formamide, N-(2-bromoallyl)- is C4H6BrNO.
The molecular weight of Formamide, N-(2-bromoallyl)- is 162.96329 g/mol.
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