Chrysene
TL;DR: Chrysene (CAS 218-01-9) is a chemical compound with molecular formula C18H12 and molecular weight 228.0939 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
chrysene
Also Known As: CHRYSENE, Benzo[a]phenanthrene, 1,2-Benzophenanthrene, Chrysen, 1,2-Benzphenanthrene
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H12 |
| Molecular Weight | 228.0939 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.0939 Da |
| Heavy Atoms | 18 |
| Complexity | 264.0 |
| Melting Point | 489 °F (NTP, 1992) |
| Boiling Point | 838 °F at 760 mmHg (NTP, 1992) |
| Density | 1.274 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Vapor Pressure | Vapor pressure: 6.3X10-7 mm Hg |
| Solubility | Insoluble. (0.0018mg/kg) (NTP, 1992) |
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43 |
| InChIKey | WDECIBYCCFPHNR-UHFFFAOYSA-N |
Product Description
Applications: Chrysene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chrysene (CAS 218-01-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Chrysene (CAS 218-01-9) is a heterocyclic building block with the molecular formula C18H12 and a molecular weight of 228.09 g/mol. Key physical properties include a density of 1.274 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: Insoluble. (0.0018mg/kg) (NTP, 1992). It is also known as CHRYSENE and Benzo[a]phenanthrene.
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 Chrysene
Property Insights of Chrysene
The XLogP value of 5.7 indicates that Chrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Chrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chrysene 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 Chrysene?
The CAS number of Chrysene is 218-01-9.
What is the molecular formula of Chrysene?
The molecular formula of Chrysene is C18H12.
What is the molecular weight of Chrysene?
The molecular weight of Chrysene is 228.0939 g/mol.
What are the applications of Chrysene?
Chrysene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chrysene (CAS 218-01-9) with custom synthesis...
Where can I buy Chrysene?
You can request a quote for Chrysene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chrysene?
Yes, CoreyChem provides custom synthesis services for Chrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.