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1,2-Dihydro-1,2-pyrenediol structure
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1,2-Dihydro-1,2-pyrenediol

TL;DR: 1,2-Dihydro-1,2-pyrenediol (CAS 158726-88-6) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,2-dihydropyrene-1,2-diol

Also Known As: 1,2-Dihydro-1,2-pyrenediol, 1,2-dihydropyrene-1,2-diol, 1,2-Pyrenediol, 1,2-dihydro-, 1,2-dihydroxy-1,2-dihydropyrene

CAS Number
158726-88-6
Molecular Formula
C16H12O2
Molecular Weight
236.08372 g/mol
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Technical Specifications

Molecular FormulaC16H12O2
Molecular Weight236.08372 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)40.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds0
Exact Mass236.08372 Da
Heavy Atoms18
Complexity411.0
SMILESC1=CC2=C3C(=C1)C=CC4=C3C(=CC(C4O)O)C=C2
InChIKeyXFEGKXLKGAJRQQ-UHFFFAOYSA-N

Chemical Property Profile of 1,2-Dihydro-1,2-pyrenediol

XLogP
2.7
TPSA (Topological Polar Surface Area)
40.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
18
Complexity
411.0
Exact Mass
236.08372
Monoisotopic Mass
236.08372
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1,2-Dihydro-1,2-pyrenediol

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydro-1,2-pyrenediol. With a topological polar surface area (TPSA) of 40.5 Ų, 1,2-Dihydro-1,2-pyrenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dihydro-1,2-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

What is the CAS number of 1,2-Dihydro-1,2-pyrenediol?

The CAS number of 1,2-Dihydro-1,2-pyrenediol is 158726-88-6.

What is the molecular formula of 1,2-Dihydro-1,2-pyrenediol?

The molecular formula of 1,2-Dihydro-1,2-pyrenediol is C16H12O2.

What is the molecular weight of 1,2-Dihydro-1,2-pyrenediol?

The molecular weight of 1,2-Dihydro-1,2-pyrenediol is 236.08372 g/mol.

Where can I buy 1,2-Dihydro-1,2-pyrenediol?

You can request a quote for 1,2-Dihydro-1,2-pyrenediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,2-Dihydro-1,2-pyrenediol?

Yes, CoreyChem provides custom synthesis services for 1,2-Dihydro-1,2-pyrenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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