6-Nitro-5-methylchrysene
TL;DR: 6-Nitro-5-methylchrysene (CAS 105802-11-7) is a chemical compound with molecular formula C19H13NO2 and molecular weight 287.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-6-nitrochrysene
Also Known As: 6-Nitro-5-methylchrysene, 5-Methyl-6-nitrochrysene, Splenotritin, Chrysene,5-methyl-6-nitro-, CHRYSENE, 5-METHYL-6-NITRO-
| Molecular Formula | C19H13NO2 |
|---|---|
| Molecular Weight | 287.09 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.09464 |
| Heavy Atoms | 22 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 105802-11-7 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3)[N+](=O)[O-] |
| InChIKey | BRHWSCIEJDCELY-UHFFFAOYSA-N |
Product Overview
6-Nitro-5-methylchrysene (CAS 105802-11-7), with molecular formula C19H13NO2 and molecular weight 287.09 g/mol. IUPAC: 5-methyl-6-nitrochrysene.
Chemical Property Profile of 6-Nitro-5-methylchrysene
Property Insights of 6-Nitro-5-methylchrysene
The XLogP value of 5.9 indicates that 6-Nitro-5-methylchrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 6-Nitro-5-methylchrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Nitro-5-methylchrysene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Nitro-5-methylchrysene?
The CAS number of 6-Nitro-5-methylchrysene is 105802-11-7.
What is the molecular formula of 6-Nitro-5-methylchrysene?
The molecular formula of 6-Nitro-5-methylchrysene is C19H13NO2.
What is the molecular weight of 6-Nitro-5-methylchrysene?
The molecular weight of 6-Nitro-5-methylchrysene is 287.09 g/mol.
Where can I buy 6-Nitro-5-methylchrysene?
You can request a quote for 6-Nitro-5-methylchrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-5-methylchrysene?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-5-methylchrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.