1-Pyrenebutanol
TL;DR: 1-Pyrenebutanol (CAS 67000-89-9) is a chemical compound with molecular formula C20H18O and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pyren-1-ylbutan-1-ol
Also Known As: 1-Pyrenebutanol, 4-pyren-1-ylbutan-1-ol, 4-(Pyren-1-yl)butan-1-ol, 1-Pyrene-1-butanol, 4-pyrenylbutan-1-ol
| Molecular Formula | C20H18O |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 4.899 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.13577 |
| Heavy Atoms | 21 |
| Complexity | 891.6849 |
Chemical Identifiers
| CAS Number | 67000-89-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCCO |
Product Overview
1-Pyrenebutanol (CAS 67000-89-9), with molecular formula C20H18O and molecular weight 274.14 g/mol. IUPAC: 4-pyren-1-ylbutan-1-ol.
Chemical Property Profile of 1-Pyrenebutanol
Property Insights of 1-Pyrenebutanol
The XLogP value of 4.899 indicates that 1-Pyrenebutanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 1-Pyrenebutanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrenebutanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Pyrenebutanol?
The CAS number of 1-Pyrenebutanol is 67000-89-9.
What is the molecular formula of 1-Pyrenebutanol?
The molecular formula of 1-Pyrenebutanol is C20H18O.
What is the molecular weight of 1-Pyrenebutanol?
The molecular weight of 1-Pyrenebutanol is 274.14 g/mol.
Where can I buy 1-Pyrenebutanol?
You can request a quote for 1-Pyrenebutanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrenebutanol?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrenebutanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.