molecular hydrogen;phenol

C6H8O — CID 86607438

IUPACmolecular hydrogen;phenol
SMILESOc1ccccc1.[H][H]
InChIInChI=1S/C6H6O.H2/c7-6-4-2-1-3-5-6;/h1-5,7H;1H
InChIKeyFOPJZUJFBVWGGV-UHFFFAOYSA-N
MW96.13 g/mol
LogP1.64
Rot. Bonds

About molecular hydrogen;phenol

molecular hydrogen;phenol (PubChem CID 86607438) has the molecular formula C6H8O and a molecular weight of 96.13 g/mol. Its IUPAC name is molecular hydrogen;phenol.

Molecular Properties

Compound Namemolecular hydrogen;phenol
PubChem CID86607438
Molecular FormulaC6H8O
Molecular Weight96.13 g/mol
Exact Mass96.06
IUPAC Namemolecular hydrogen;phenol
SMILESOc1ccccc1.[H][H]
InChIInChI=1S/C6H6O.H2/c7-6-4-2-1-3-5-6;/h1-5,7H;1H
InChIKeyFOPJZUJFBVWGGV-UHFFFAOYSA-N
XLogP1.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

molybdenum;phenol
CID 154246724
argon;phenol
CID 159678450
phenol;phosphane
CID 159689182
CID 67496590
CID 67496590
phenol;tantalum
CID 19915613
neodymium;phenol
CID 154361260
phenol;titanium(2+)
CID 23042599
CID 159904044
CID 159904044
aluminum phenol
CID 19023057
CID 161001247
CID 161001247
phenol;chloride
CID 23313261
phenol;bis(yttrium)
CID 59089942

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;phenol?
The IUPAC name of molecular hydrogen;phenol (CID 86607438) is molecular hydrogen;phenol.
What is the SMILES notation for molecular hydrogen;phenol?
The canonical SMILES for molecular hydrogen;phenol is Oc1ccccc1.[H][H].
What is the InChIKey of molecular hydrogen;phenol?
The InChIKey is FOPJZUJFBVWGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.H2/c7-6-4-2-1-3-5-6;/h1-5,7H;1H.
What are the key properties of molecular hydrogen;phenol?
molecular hydrogen;phenol has a molecular weight of 96.13 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;phenol is sourced from PubChem (CID 86607438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).