TL;DR: 5-Bromo-2-methylisoindoline (CAS 107834-37-7) is a chemical compound with molecular formula C9H10BrN and molecular weight 210.99966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-2-methyl-1,3-dihydroisoindole
Also Known As: 5-bromo-2-methylisoindoline, 5-bromo-2-methyl-isoindoline, 5-bromo-2-methyl-1,3-dihydroisoindole, 5-Bromo-2,3-dihydro-2-methyl-1H-isoindole, 5-bromo-2-methyl-2,3-dihydro-1H-isoindole
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H10BrN |
| Molecular Weight | 210.99966 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.99966 Da |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
| SMILES | CN1CC2=C(C1)C=C(C=C2)Br |
| InChIKey | MOUHJQRCBSCPEX-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-methylisoindoline. With a topological polar surface area (TPSA) of 3.2 Ų, 5-Bromo-2-methylisoindoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-methylisoindoline 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 5-Bromo-2-methylisoindoline is 107834-37-7.
The molecular formula of 5-Bromo-2-methylisoindoline is C9H10BrN.
The molecular weight of 5-Bromo-2-methylisoindoline is 210.99966 g/mol.
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