bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))

C4H10O14P4Pb3 — CID 173412535

IUPACbis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))
SMILESCOP(=O)([O-])C(O)P(=O)([O-])[O-].COP(=O)([O-])C(O)P(=O)([O-])[O-].[Pb+2].[Pb+2].[Pb+2]
InChIInChI=1S/2C2H8O7P2.3Pb/c2*1-9-11(7,8)2(3)10(4,5)6;;;/h2*2-3H,1H3,(H,7,8)(H2,4,5,6);;;/q;;3*+2/p-6
InChIKeyJQLWMTVDIFSEQI-UHFFFAOYSA-H
MW1027.61 g/mol
LogP-6.39
Rot. Bonds6

About bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))

bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)) (PubChem CID 173412535) has the molecular formula C4H10O14P4Pb3 and a molecular weight of 1027.61 g/mol. Its IUPAC name is bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)).

Molecular Properties

Compound Namebis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))
PubChem CID173412535
Molecular FormulaC4H10O14P4Pb3
Molecular Weight1027.61 g/mol
Exact Mass1029.83
IUPAC Namebis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))
SMILESCOP(=O)([O-])C(O)P(=O)([O-])[O-].COP(=O)([O-])C(O)P(=O)([O-])[O-].[Pb+2].[Pb+2].[Pb+2]
InChIInChI=1S/2C2H8O7P2.3Pb/c2*1-9-11(7,8)2(3)10(4,5)6;;;/h2*2-3H,1H3,(H,7,8)(H2,4,5,6);;;/q;;3*+2/p-6
InChIKeyJQLWMTVDIFSEQI-UHFFFAOYSA-H
XLogP-6.39
TPSA265.56 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001027.61
LogP ≤ 5-6.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

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Related Compounds

dipotassium;[hydroxy(phosphonato)methyl]phosphonic acid
CID 155666645
[dimethoxyphosphoryl(fluoro)methyl]-methoxyphosphinate
CID 164683979
dipotassium;1-phosphonatoethanol
CID 22352114
lithium (1-acetyloxy-2-oxopropyl)-methoxyphosphinate
CID 140811021
bis((2-chlorophenoxy)-[hydroxy(phosphonato)methyl]phosphinate);tris(tin(2+))
CID 173412876
methylazanium;methyl phosphate
CID 141397686
phosphanium dimethyl phosphate
CID 118555188
trisodium;propan-2-ol;phosphate
CID 174993570
barium(2+);bis(dimethyl phosphate)
CID 3835926
dimethylphosphinate;methoxy(methyl)phosphinate
CID 161267325
lithium;iron(3+);methyl phosphate
CID 173011115
tetrasodium;hydride;tetrakis([hydroxy-[hydroxy(methoxy)phosphoryl]methyl]phosphonic acid)
CID 173412667

Frequently Asked Questions

What is the IUPAC name of bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))?
The IUPAC name of bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)) (CID 173412535) is bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)).
What is the SMILES notation for bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))?
The canonical SMILES for bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)) is COP(=O)([O-])C(O)P(=O)([O-])[O-].COP(=O)([O-])C(O)P(=O)([O-])[O-].[Pb+2].[Pb+2].[Pb+2].
What is the InChIKey of bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))?
The InChIKey is JQLWMTVDIFSEQI-UHFFFAOYSA-H. The full InChI is InChI=1S/2C2H8O7P2.3Pb/c2*1-9-11(7,8)2(3)10(4,5)6;;;/h2*2-3H,1H3,(H,7,8)(H2,4,5,6);;;/q;;3*+2/p-6.
What are the key properties of bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+))?
bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)) has a molecular weight of 1027.61 g/mol, XLogP of -6.39, 6 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for bis([hydroxy(phosphonato)methyl]-methoxyphosphinate);tris(lead(2+)) is sourced from PubChem (CID 173412535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).