TL;DR: 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine (CAS 101077-14-9) is a chemical compound with molecular formula C7H11Br2N and molecular weight 266.9258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-N-(2-bromoprop-2-enyl)-N-methylprop-2-en-1-amine
Also Known As: NCIStruc1_000388, NCIStruc2_000587, N,N-Bis(2-bromoallyl)methylamine, bis-(2-bromo-allyl)-methyl-amine, NCI60_004314
| Molecular Formula | C7H11Br2N |
| Molecular Weight | 266.9258 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.9258 Da |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
| SMILES | CN(CC(=C)Br)CC(=C)Br |
| InChIKey | LBJKANBIQPSNGD-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine. With a topological polar surface area (TPSA) of 3.2 Ų, 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine has 0 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 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine is 101077-14-9.
The molecular formula of 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine is C7H11Br2N.
The molecular weight of 2-bromo-N-(2-bromo-2-propenyl)-N-methyl-2-propen-1-amine is 266.9258 g/mol.
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