phenol;1-phosphorosonaphthalene

C16H13O2P — CID 174456748

IUPACphenol;1-phosphorosonaphthalene
SMILESO=Pc1cccc2ccccc12.Oc1ccccc1
InChIInChI=1S/C10H7OP.C6H6O/c11-12-10-7-3-5-8-4-1-2-6-9(8)10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H
InChIKeyQSDDRNCUZORRLQ-UHFFFAOYSA-N
MW268.25 g/mol
LogP4.15
Rot. Bonds1

About phenol;1-phosphorosonaphthalene

phenol;1-phosphorosonaphthalene (PubChem CID 174456748) has the molecular formula C16H13O2P and a molecular weight of 268.25 g/mol. Its IUPAC name is phenol;1-phosphorosonaphthalene.

Molecular Properties

Compound Namephenol;1-phosphorosonaphthalene
PubChem CID174456748
Molecular FormulaC16H13O2P
Molecular Weight268.25 g/mol
Exact Mass268.07
IUPAC Namephenol;1-phosphorosonaphthalene
SMILESO=Pc1cccc2ccccc12.Oc1ccccc1
InChIInChI=1S/C10H7OP.C6H6O/c11-12-10-7-3-5-8-4-1-2-6-9(8)10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H
InChIKeyQSDDRNCUZORRLQ-UHFFFAOYSA-N
XLogP4.15
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.25
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of phenol;1-phosphorosonaphthalene?
The IUPAC name of phenol;1-phosphorosonaphthalene (CID 174456748) is phenol;1-phosphorosonaphthalene.
What is the SMILES notation for phenol;1-phosphorosonaphthalene?
The canonical SMILES for phenol;1-phosphorosonaphthalene is O=Pc1cccc2ccccc12.Oc1ccccc1.
What is the InChIKey of phenol;1-phosphorosonaphthalene?
The InChIKey is QSDDRNCUZORRLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7OP.C6H6O/c11-12-10-7-3-5-8-4-1-2-6-9(8)10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H.
What are the key properties of phenol;1-phosphorosonaphthalene?
phenol;1-phosphorosonaphthalene has a molecular weight of 268.25 g/mol, XLogP of 4.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenol;1-phosphorosonaphthalene is sourced from PubChem (CID 174456748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).