3-Methylchrysene
TL;DR: 3-Methylchrysene (CAS 3351-31-3) is a chemical compound with molecular formula C19H14 and molecular weight 242.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylchrysene
Also Known As: 3-METHYLCHRYSENE, 3-Methyl Chrysene, Chrysene, 3-methyl-, 3-methyl-chrysen, BCR079R_FLUKA
| Molecular Formula | C19H14 |
|---|---|
| Molecular Weight | 242.11 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 242.10954 |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 3351-31-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C=CC3=C2C=CC4=CC=CC=C43 |
| InChIKey | JLIHUJWAXSZIHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylchrysene (CAS 3351-31-3), with molecular formula C19H14 and molecular weight 242.11 g/mol. IUPAC: 3-methylchrysene.
Chemical Property Profile of 3-Methylchrysene
Property Insights of 3-Methylchrysene
The XLogP value of 6.4 indicates that 3-Methylchrysene 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-Methylchrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylchrysene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methylchrysene?
The CAS number of 3-Methylchrysene is 3351-31-3.
What is the molecular formula of 3-Methylchrysene?
The molecular formula of 3-Methylchrysene is C19H14.
What is the molecular weight of 3-Methylchrysene?
The molecular weight of 3-Methylchrysene is 242.11 g/mol.
Where can I buy 3-Methylchrysene?
You can request a quote for 3-Methylchrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylchrysene?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylchrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.