3,9-Dimethylbenz(a)anthracene
TL;DR: 3,9-Dimethylbenz(a)anthracene (CAS 316-51-8) 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.
3,9-dimethylbenzo[a]anthracene
Also Known As: 3,9-Dimethylbenz[a]anthracene, 3,9-dimethyltetraphene, 3,9-dimethylbenzo[a]anthracene, 3,9-Dimethylbenz(a)anthracene, BENZ(a)ANTHRACENE, 3,9-DIMETHYL-
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H16 |
| Molecular Weight | 256.1252 g/mol |
| XLogP | 6.8 |
| 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=C(C=C1)C3=CC4=C(C=C(C=C4)C)C=C3C=C2 |
| InChIKey | DBPDWIZRMPUWRH-UHFFFAOYSA-N |
Product Description
Applications: 3,9-Dimethylbenz(a)anthracene is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
3,9-Dimethylbenz(a)anthracene is a pharmaceutical intermediate identified by CAS number 316-51-8 and the molecular formula C20H16 and a molecular weight of 256.13 g/mol. Synonyms include 3,9-Dimethylbenz[a]anthracene and 3,9-dimethyltetraphene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3,9-Dimethylbenz(a)anthracene
Property Insights of 3,9-Dimethylbenz(a)anthracene
The XLogP value of 6.8 indicates that 3,9-Dimethylbenz(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, 3,9-Dimethylbenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,9-Dimethylbenz(a)anthracene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3,9-Dimethylbenz(a)anthracene?
The CAS number of 3,9-Dimethylbenz(a)anthracene is 316-51-8.
What is the molecular formula of 3,9-Dimethylbenz(a)anthracene?
The molecular formula of 3,9-Dimethylbenz(a)anthracene is C20H16.
What is the molecular weight of 3,9-Dimethylbenz(a)anthracene?
The molecular weight of 3,9-Dimethylbenz(a)anthracene is 256.1252 g/mol.
What are the applications of 3,9-Dimethylbenz(a)anthracene?
3,9-Dimethylbenz(a)anthracene is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog...
Where can I buy 3,9-Dimethylbenz(a)anthracene?
You can request a quote for 3,9-Dimethylbenz(a)anthracene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,9-Dimethylbenz(a)anthracene?
Yes, CoreyChem provides custom synthesis services for 3,9-Dimethylbenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.