1-Phenylpyrene
TL;DR: 1-Phenylpyrene (CAS 5101-27-9) is a chemical compound with molecular formula C22H14 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpyrene
Also Known As: 1-Phenylpyrene, Pyrene, 1-phenyl-, 3-Phenylpyrene, 1-Phenyl-pyren, 1-Phenylpyrene #
| Molecular Formula | C22H14 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.10956 |
| Heavy Atoms | 22 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 5101-27-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2 |
| InChIKey | QRVQUBKLRBKFCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenylpyrene (CAS 5101-27-9), with molecular formula C22H14 and molecular weight 278.11 g/mol. IUPAC: 1-phenylpyrene.
Chemical Property Profile of 1-Phenylpyrene
Property Insights of 1-Phenylpyrene
The XLogP value of 6.7 indicates that 1-Phenylpyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Phenylpyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenylpyrene 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 1-Phenylpyrene?
The CAS number of 1-Phenylpyrene is 5101-27-9.
What is the molecular formula of 1-Phenylpyrene?
The molecular formula of 1-Phenylpyrene is C22H14.
What is the molecular weight of 1-Phenylpyrene?
The molecular weight of 1-Phenylpyrene is 278.11 g/mol.
Where can I buy 1-Phenylpyrene?
You can request a quote for 1-Phenylpyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenylpyrene?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenylpyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.