TL;DR: Benz(a)anthracene, 6,7-dimethyl- (CAS 20627-28-5) is a chemical compound with molecular formula C20H16 and molecular weight 256.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethylbenzo[a]anthracene
Also Known As: 6,7-dimethyltetraphene, 6,7-Dimethylbenz(a)anthracene, 6,7-Dimethylbenz[a]anthracene, Benz(a)anthracene, 6,7-dimethyl-, 4,10-Dimethyl-1,2-benzanthracene
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H16 |
| Molecular Weight | 256.1252 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.1252 Da |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| SMILES | CC1=CC2=CC=CC=C2C3=CC4=CC=CC=C4C(=C13)C |
| InChIKey | WPDOEEIWRBGJOK-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that Benz(a)anthracene, 6,7-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benz(a)anthracene, 6,7-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(a)anthracene, 6,7-dimethyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benz(a)anthracene, 6,7-dimethyl- is 20627-28-5.
The molecular formula of Benz(a)anthracene, 6,7-dimethyl- is C20H16.
The molecular weight of Benz(a)anthracene, 6,7-dimethyl- is 256.1252 g/mol.
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