苯並［e］芘
TL;DR: 苯並［e］芘 (CAS 192-97-2) is a chemical compound with molecular formula C20H12 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯並［e］芘
benzo[e]pyrene
Also Known As: Benzo[e]pyrene, BENZO(E)PYRENE, 1,2-Benzpyrene, 4,5-Benzpyrene, 4,5-Benzopyrene
| Molecular Formula | C20H12 |
|---|---|
| Molecular Weight | 252.09 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 | 252.0939 |
| Heavy Atoms | 20 |
| Complexity | 336.0 |
| Melting Point | 352 to 178.9 °C |
| Boiling Point | 492.2 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Vapor Pressure | 0.00000001 [mmHg] |
Chemical Identifiers
| CAS Number | 192-97-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=CC=C25)C=C4 |
| InChIKey | TXVHTIQJNYSSKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯並［e］芘 (CAS 192-97-2), with molecular formula C20H12 and molecular weight 252.09 g/mol. IUPAC: benzo[e]pyrene.
Chemical Property Profile of 苯並［e］芘
Property Insights of 苯並［e］芘
The XLogP value of 6.4 indicates that 苯並［e］芘 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 苯並［e］芘 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯並［e］芘 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 苯並［e］芘?
The CAS number of 苯並［e］芘 is 192-97-2.
What is the molecular formula of 苯並［e］芘?
The molecular formula of 苯並［e］芘 is C20H12.
What is the molecular weight of 苯並［e］芘?
The molecular weight of 苯並［e］芘 is 252.09 g/mol.
Where can I buy 苯並［e］芘?
You can request a quote for 苯並［e］芘 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯並［e］芘?
Yes, KEHONG BIO provides custom synthesis services for 苯並［e］芘 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.