TL;DR: 7-(Bromomethyl)benz(a)anthracene (CAS 24961-39-5) is a chemical compound with molecular formula C19H13Br and molecular weight 320.02005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(bromomethyl)benzo[a]anthracene
Also Known As: 7-Bromomethylbenzanthracene, 7-Bmba, 7-Bromomethylbenz(a)anthracene, 7-(Bromomethyl)benz(a)anthracene, 7-bromomethylbenz[a]anthracene
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H13Br |
| Molecular Weight | 320.02005 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.02005 Da |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CBr |
| InChIKey | QUVSFZCWYBQJJK-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that 7-(Bromomethyl)benz(a)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 7-(Bromomethyl)benz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(Bromomethyl)benz(a)anthracene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 7-(Bromomethyl)benz(a)anthracene is 24961-39-5.
The molecular formula of 7-(Bromomethyl)benz(a)anthracene is C19H13Br.
The molecular weight of 7-(Bromomethyl)benz(a)anthracene is 320.02005 g/mol.
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