sodium;hydride;2-phenylphenol;4-phenylphenol

C24H21NaO2 — CID 173165495

IUPACsodium;hydride;2-phenylphenol;4-phenylphenol
SMILESOc1ccc(-c2ccccc2)cc1.Oc1ccccc1-c1ccccc1.[H-].[Na+]
InChIInChI=1S/2C12H10O.Na.H/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;;/h2*1-9,13H;;/q;;+1;-1
InChIKeyJTUQVCCSLPOBHV-UHFFFAOYSA-N
MW364.42 g/mol
LogP3.23
Rot. Bonds2

About sodium;hydride;2-phenylphenol;4-phenylphenol

sodium;hydride;2-phenylphenol;4-phenylphenol (PubChem CID 173165495) has the molecular formula C24H21NaO2 and a molecular weight of 364.42 g/mol. Its IUPAC name is sodium;hydride;2-phenylphenol;4-phenylphenol.

Molecular Properties

Compound Namesodium;hydride;2-phenylphenol;4-phenylphenol
PubChem CID173165495
Molecular FormulaC24H21NaO2
Molecular Weight364.42 g/mol
Exact Mass364.14
IUPAC Namesodium;hydride;2-phenylphenol;4-phenylphenol
SMILESOc1ccc(-c2ccccc2)cc1.Oc1ccccc1-c1ccccc1.[H-].[Na+]
InChIInChI=1S/2C12H10O.Na.H/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;;/h2*1-9,13H;;/q;;+1;-1
InChIKeyJTUQVCCSLPOBHV-UHFFFAOYSA-N
XLogP3.23
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of sodium;hydride;2-phenylphenol;4-phenylphenol?
The IUPAC name of sodium;hydride;2-phenylphenol;4-phenylphenol (CID 173165495) is sodium;hydride;2-phenylphenol;4-phenylphenol.
What is the SMILES notation for sodium;hydride;2-phenylphenol;4-phenylphenol?
The canonical SMILES for sodium;hydride;2-phenylphenol;4-phenylphenol is Oc1ccc(-c2ccccc2)cc1.Oc1ccccc1-c1ccccc1.[H-].[Na+].
What is the InChIKey of sodium;hydride;2-phenylphenol;4-phenylphenol?
The InChIKey is JTUQVCCSLPOBHV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H10O.Na.H/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;;/h2*1-9,13H;;/q;;+1;-1.
What are the key properties of sodium;hydride;2-phenylphenol;4-phenylphenol?
sodium;hydride;2-phenylphenol;4-phenylphenol has a molecular weight of 364.42 g/mol, XLogP of 3.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;2-phenylphenol;4-phenylphenol is sourced from PubChem (CID 173165495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).