TL;DR: 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide (CAS 35059-15-5) is a chemical compound with molecular formula C12H18BrNO2 and molecular weight 287.0521 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5,6-dihydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)-dimethylazanium bromide
Also Known As: M 7, hydrobromide, 6-Dimethylamino-5,6,7,8-tetrahydro-1,2-naphthalenediol hydrobromide, 1,2-NAPHTHALENEDIOL, 5,6,7,8-TETRAHYDRO-6-DIMETHYLAMINO-, HYDROBROMIDE, (5,6-dihydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)-dimethylazanium bromide, 1,2-Naphthalenediol, 6-(dimethylamino)-5,6,7,8-tetrahydro-, hydrobromide
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H18BrNO2 |
| Molecular Weight | 287.0521 g/mol |
| XLogP | -2.9 |
| Topological Polar Surface Area (TPSA) | 44.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 287.0521 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | C[NH+](C)C1CCC2=C(C1)C=CC(=C2O)O.[Br-] |
| InChIKey | ZVEPOABKGHLGNE-UHFFFAOYSA-N |
The XLogP value of -2.9 indicates that 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.9 Ų, 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide is 35059-15-5.
The molecular formula of 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide is C12H18BrNO2.
The molecular weight of 1,2-Naphthalenediol, 5,6,7,8-tetrahydro-6-dimethylamino-, hydrobromide is 287.0521 g/mol.
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