CID 66709852

C6H5NaO2P — CID 66709852

IUPAC—
SMILESO=POc1ccccc1.[Na]
InChIInChI=1S/C6H5O2P.Na/c7-9-8-6-4-2-1-3-5-6;/h1-5H;
InChIKeyUEVKQGFCWPSGHG-UHFFFAOYSA-N
MW163.07 g/mol
LogP1.89
Rot. Bonds2

About CID 66709852

CID 66709852 (PubChem CID 66709852) has the molecular formula C6H5NaO2P and a molecular weight of 163.07 g/mol.

Molecular Properties

Compound NameCID 66709852
PubChem CID66709852
Molecular FormulaC6H5NaO2P
Molecular Weight163.07 g/mol
Exact Mass162.99
IUPAC Name—
SMILESO=POc1ccccc1.[Na]
InChIInChI=1S/C6H5O2P.Na/c7-9-8-6-4-2-1-3-5-6;/h1-5H;
InChIKeyUEVKQGFCWPSGHG-UHFFFAOYSA-N
XLogP1.89
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.07
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 66709852?
The IUPAC name of CID 66709852 (CID 66709852) is not available.
What is the SMILES notation for CID 66709852?
The canonical SMILES for CID 66709852 is O=POc1ccccc1.[Na].
What is the InChIKey of CID 66709852?
The InChIKey is UEVKQGFCWPSGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5O2P.Na/c7-9-8-6-4-2-1-3-5-6;/h1-5H;.
What are the key properties of CID 66709852?
CID 66709852 has a molecular weight of 163.07 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66709852 is sourced from PubChem (CID 66709852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).