hydrogen phosphate;bis(lutetium(3+))

H3Lu2O12P3 — CID 159566068

IUPAChydrogen phosphate;bis(lutetium(3+))
SMILESO=P([O-])([O-])O.O=P([O-])([O-])O.O=P([O-])([O-])O.[Lu+3].[Lu+3]
InChIInChI=1S/2Lu.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q2*+3;;;/p-6
InChIKeyMHFCDZSBJAYUHA-UHFFFAOYSA-H
MW637.87 g/mol
LogP-6.58
Rot. Bonds

About hydrogen phosphate;bis(lutetium(3+))

hydrogen phosphate;bis(lutetium(3+)) (PubChem CID 159566068) has the molecular formula H3Lu2O12P3 and a molecular weight of 637.87 g/mol. Its IUPAC name is hydrogen phosphate;bis(lutetium(3+)).

Molecular Properties

Compound Namehydrogen phosphate;bis(lutetium(3+))
PubChem CID159566068
Molecular FormulaH3Lu2O12P3
Molecular Weight637.87 g/mol
Exact Mass637.77
IUPAC Namehydrogen phosphate;bis(lutetium(3+))
SMILESO=P([O-])([O-])O.O=P([O-])([O-])O.O=P([O-])([O-])O.[Lu+3].[Lu+3]
InChIInChI=1S/2Lu.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q2*+3;;;/p-6
InChIKeyMHFCDZSBJAYUHA-UHFFFAOYSA-H
XLogP-6.58
TPSA250.26 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500637.87
LogP ≤ 5-6.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

bis(chromium(3+));hydrogen phosphate
CID 19708255
hafnium;hydrogen phosphate
CID 160536753
barium(2+);hydrogen phosphate;phosphane
CID 172784321
calcium;copper;hydrogen phosphate
CID 14367930
pentaaluminum;hydrogen phosphate;triphosphate
CID 174876626
azane;cadmium(2+);hydrogen phosphate
CID 170850402
diazanium;hydrogen phosphate;sulfane
CID 173018779
potassium;hydrogen phosphate;rubidium(1+)
CID 175565862
tetrasodium;bis(dihydrogen phosphate);hydrogen phosphate
CID 19757615
aluminum;hydrogen phosphate;fluoride
CID 157444743
dimagnesium;hydrogen phosphate;hydroxide
CID 157147933
sodium;hydrogen phosphate;dodecahydrate
CID 18980410

Frequently Asked Questions

What is the IUPAC name of hydrogen phosphate;bis(lutetium(3+))?
The IUPAC name of hydrogen phosphate;bis(lutetium(3+)) (CID 159566068) is hydrogen phosphate;bis(lutetium(3+)).
What is the SMILES notation for hydrogen phosphate;bis(lutetium(3+))?
The canonical SMILES for hydrogen phosphate;bis(lutetium(3+)) is O=P([O-])([O-])O.O=P([O-])([O-])O.O=P([O-])([O-])O.[Lu+3].[Lu+3].
What is the InChIKey of hydrogen phosphate;bis(lutetium(3+))?
The InChIKey is MHFCDZSBJAYUHA-UHFFFAOYSA-H. The full InChI is InChI=1S/2Lu.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q2*+3;;;/p-6.
What are the key properties of hydrogen phosphate;bis(lutetium(3+))?
hydrogen phosphate;bis(lutetium(3+)) has a molecular weight of 637.87 g/mol, XLogP of -6.58, 0 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for hydrogen phosphate;bis(lutetium(3+)) is sourced from PubChem (CID 159566068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).