1-(6-Benzo(a)pyrenyl)ethanol
TL;DR: 1-(6-Benzo(a)pyrenyl)ethanol (CAS 36271-80-4) is a chemical compound with molecular formula C22H16O and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzo[b]pyren-6-ylethanol
Also Known As: 1-(6-Benzo(a)pyrenyl)ethanol, 1-(6-benzo[a]pyrenyl)ethanol, 1-benzo[b]pyren-6-ylethanol, A-Galactosyl-C18-ceramide, alpha-Methylbenzo(a)pyrene-6-methanol
| Molecular Formula | C22H16O |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.12012 |
| Heavy Atoms | 23 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 36271-80-4 |
|---|---|
| SMILES | CC(C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51)O |
| InChIKey | PUSCZGPNNARBNH-UHFFFAOYSA-N |
Product Overview
1-(6-Benzo(a)pyrenyl)ethanol (CAS 36271-80-4), with molecular formula C22H16O and molecular weight 296.12 g/mol. IUPAC: 1-benzo[b]pyren-6-ylethanol.
Chemical Property Profile of 1-(6-Benzo(a)pyrenyl)ethanol
Property Insights of 1-(6-Benzo(a)pyrenyl)ethanol
The XLogP value of 5.8 indicates that 1-(6-Benzo(a)pyrenyl)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1-(6-Benzo(a)pyrenyl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6-Benzo(a)pyrenyl)ethanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(6-Benzo(a)pyrenyl)ethanol?
The CAS number of 1-(6-Benzo(a)pyrenyl)ethanol is 36271-80-4.
What is the molecular formula of 1-(6-Benzo(a)pyrenyl)ethanol?
The molecular formula of 1-(6-Benzo(a)pyrenyl)ethanol is C22H16O.
What is the molecular weight of 1-(6-Benzo(a)pyrenyl)ethanol?
The molecular weight of 1-(6-Benzo(a)pyrenyl)ethanol is 296.12 g/mol.
Where can I buy 1-(6-Benzo(a)pyrenyl)ethanol?
You can request a quote for 1-(6-Benzo(a)pyrenyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Benzo(a)pyrenyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Benzo(a)pyrenyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.