4,5-Dihydro-4,5-pyrenediol
TL;DR: 4,5-Dihydro-4,5-pyrenediol (CAS 101313-25-1) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydropyrene-4,5-diol
Also Known As: 4,5-dihydropyrene-4,5-diol, 4,5-Dihydro-4,5-pyrenediol, 4,5-Pyrenediol, 4,5-dihydro-, 4,5-dihydro-4,5-dihydroxypyrene, 4,5-dihydroxy-4,5-dihydropyrene
| Molecular Formula | C16H12O2 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.08372 |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 101313-25-1 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C(C(C4=CC=CC(=C43)C=C2)O)O |
| InChIKey | NIUGQCSXPHANNG-UHFFFAOYSA-N |
Product Overview
4,5-Dihydro-4,5-pyrenediol (CAS 101313-25-1), with molecular formula C16H12O2 and molecular weight 236.08 g/mol. IUPAC: 4,5-dihydropyrene-4,5-diol.
Chemical Property Profile of 4,5-Dihydro-4,5-pyrenediol
Property Insights of 4,5-Dihydro-4,5-pyrenediol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dihydro-4,5-pyrenediol. With a topological polar surface area (TPSA) of 40.5 Ų, 4,5-Dihydro-4,5-pyrenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dihydro-4,5-pyrenediol has 2 hydrogen bond donor(s) and 2 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 4,5-Dihydro-4,5-pyrenediol?
The CAS number of 4,5-Dihydro-4,5-pyrenediol is 101313-25-1.
What is the molecular formula of 4,5-Dihydro-4,5-pyrenediol?
The molecular formula of 4,5-Dihydro-4,5-pyrenediol is C16H12O2.
What is the molecular weight of 4,5-Dihydro-4,5-pyrenediol?
The molecular weight of 4,5-Dihydro-4,5-pyrenediol is 236.08 g/mol.
Where can I buy 4,5-Dihydro-4,5-pyrenediol?
You can request a quote for 4,5-Dihydro-4,5-pyrenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dihydro-4,5-pyrenediol?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dihydro-4,5-pyrenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.