sodium;hydride;phenacyl(phenoxy)phosphinic acid

C14H14NaO4P — CID 174747840

IUPACsodium;hydride;phenacyl(phenoxy)phosphinic acid
SMILESO=C(CP(=O)(O)Oc1ccccc1)c1ccccc1.[H-].[Na+]
InChIInChI=1S/C14H13O4P.Na.H/c15-14(12-7-3-1-4-8-12)11-19(16,17)18-13-9-5-2-6-10-13;;/h1-10H,11H2,(H,16,17);;/q;+1;-1
InChIKeyFHHPXIIUJOIYSE-UHFFFAOYSA-N
MW300.23 g/mol
LogP0.25
Rot. Bonds5

About sodium;hydride;phenacyl(phenoxy)phosphinic acid

sodium;hydride;phenacyl(phenoxy)phosphinic acid (PubChem CID 174747840) has the molecular formula C14H14NaO4P and a molecular weight of 300.23 g/mol. Its IUPAC name is sodium;hydride;phenacyl(phenoxy)phosphinic acid.

Molecular Properties

Compound Namesodium;hydride;phenacyl(phenoxy)phosphinic acid
PubChem CID174747840
Molecular FormulaC14H14NaO4P
Molecular Weight300.23 g/mol
Exact Mass300.05
IUPAC Namesodium;hydride;phenacyl(phenoxy)phosphinic acid
SMILESO=C(CP(=O)(O)Oc1ccccc1)c1ccccc1.[H-].[Na+]
InChIInChI=1S/C14H13O4P.Na.H/c15-14(12-7-3-1-4-8-12)11-19(16,17)18-13-9-5-2-6-10-13;;/h1-10H,11H2,(H,16,17);;/q;+1;-1
InChIKeyFHHPXIIUJOIYSE-UHFFFAOYSA-N
XLogP0.25
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.23
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

sodium;hydride;phenacyl(phenylmethoxy)phosphinic acid
CID 174747864
tetrasodium;hydride;[hydroxy(phenoxy)phosphoryl]methylphosphonic acid
CID 173412594
2,2-dimethylpropyl(phenoxy)phosphinic acid
CID 20835951
benzyl(phenoxy)phosphinic acid
CID 54071062
2-bis(trimethylsilyloxy)phosphoryl-1-phenylethanone
CID 12671866
2-dimethylphosphoryl-1-phenylethanone
CID 555432
2-[bis(hydroxymethyl)phosphoryl]-1-phenylethanone
CID 71357134
phenoxy(undecyl)phosphinic acid
CID 87383274
tris(diphenyl hydrogen phosphate);phosphane
CID 172751224
diphenyl hydrogen phosphate;dihydrate
CID 21115845
CID 131875092
CID 131875092
diphenyl hydrogen phosphate;silane
CID 175425543

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;phenacyl(phenoxy)phosphinic acid?
The IUPAC name of sodium;hydride;phenacyl(phenoxy)phosphinic acid (CID 174747840) is sodium;hydride;phenacyl(phenoxy)phosphinic acid.
What is the SMILES notation for sodium;hydride;phenacyl(phenoxy)phosphinic acid?
The canonical SMILES for sodium;hydride;phenacyl(phenoxy)phosphinic acid is O=C(CP(=O)(O)Oc1ccccc1)c1ccccc1.[H-].[Na+].
What is the InChIKey of sodium;hydride;phenacyl(phenoxy)phosphinic acid?
The InChIKey is FHHPXIIUJOIYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13O4P.Na.H/c15-14(12-7-3-1-4-8-12)11-19(16,17)18-13-9-5-2-6-10-13;;/h1-10H,11H2,(H,16,17);;/q;+1;-1.
What are the key properties of sodium;hydride;phenacyl(phenoxy)phosphinic acid?
sodium;hydride;phenacyl(phenoxy)phosphinic acid has a molecular weight of 300.23 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;phenacyl(phenoxy)phosphinic acid is sourced from PubChem (CID 174747840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).