6-Propoxybenzo(a)pyren-1-ol
TL;DR: 6-Propoxybenzo(a)pyren-1-ol (CAS 74192-63-5) is a chemical compound with molecular formula C23H18O2 and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-propoxybenzo[a]pyren-1-ol
Also Known As: 6-Propoxybenzo(a)pyren-1-ol, 6-propoxybenzo[a]pyren-1-ol, 6-propoxybenzo[pqr]tetraphen-1-ol
| Molecular Formula | C23H18O2 |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.13068 |
| Heavy Atoms | 25 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 74192-63-5 |
|---|---|
| SMILES | CCCOC1=C2C=CC3=C4C2=C(C=CC4=C(C=C3)O)C5=CC=CC=C51 |
| InChIKey | NMRGAXLEGPOKLW-UHFFFAOYSA-N |
Product Overview
6-Propoxybenzo(a)pyren-1-ol (CAS 74192-63-5), with molecular formula C23H18O2 and molecular weight 326.13 g/mol. IUPAC: 6-propoxybenzo[a]pyren-1-ol.
Chemical Property Profile of 6-Propoxybenzo(a)pyren-1-ol
Property Insights of 6-Propoxybenzo(a)pyren-1-ol
The XLogP value of 6.8 indicates that 6-Propoxybenzo(a)pyren-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 6-Propoxybenzo(a)pyren-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Propoxybenzo(a)pyren-1-ol has 1 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-Propoxybenzo(a)pyren-1-ol?
The CAS number of 6-Propoxybenzo(a)pyren-1-ol is 74192-63-5.
What is the molecular formula of 6-Propoxybenzo(a)pyren-1-ol?
The molecular formula of 6-Propoxybenzo(a)pyren-1-ol is C23H18O2.
What is the molecular weight of 6-Propoxybenzo(a)pyren-1-ol?
The molecular weight of 6-Propoxybenzo(a)pyren-1-ol is 326.13 g/mol.
Where can I buy 6-Propoxybenzo(a)pyren-1-ol?
You can request a quote for 6-Propoxybenzo(a)pyren-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Propoxybenzo(a)pyren-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 6-Propoxybenzo(a)pyren-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.