[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten

C9H19O7P2W- — CID 58800954

IUPAC[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten
SMILESCO[C@@H]1[CH-]C[C@H](COP(C)(=O)O)C1OP(C)(=O)O.[W]
InChIInChI=1S/C9H19O7P2.W/c1-14-8-5-4-7(6-15-17(2,10)11)9(8)16-18(3,12)13;/h5,7-9H,4,6H2,1-3H3,(H,10,11)(H,12,13);/q-1;/t7-,8-,9?;/m1./s1
InChIKeyLGKLHNGBNXQFCR-HMEHNGNUSA-N
MW485.03 g/mol
LogP1.26
Rot. Bonds6

About [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten

[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten (PubChem CID 58800954) has the molecular formula C9H19O7P2W- and a molecular weight of 485.03 g/mol. Its IUPAC name is [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten.

Molecular Properties

Compound Name[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten
PubChem CID58800954
Molecular FormulaC9H19O7P2W-
Molecular Weight485.03 g/mol
Exact Mass485.01
IUPAC Name[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten
SMILESCO[C@@H]1[CH-]C[C@H](COP(C)(=O)O)C1OP(C)(=O)O.[W]
InChIInChI=1S/C9H19O7P2.W/c1-14-8-5-4-7(6-15-17(2,10)11)9(8)16-18(3,12)13;/h5,7-9H,4,6H2,1-3H3,(H,10,11)(H,12,13);/q-1;/t7-,8-,9?;/m1./s1
InChIKeyLGKLHNGBNXQFCR-HMEHNGNUSA-N
XLogP1.26
TPSA102.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.03
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten?
The IUPAC name of [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten (CID 58800954) is [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten.
What is the SMILES notation for [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten?
The canonical SMILES for [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten is CO[C@@H]1[CH-]C[C@H](COP(C)(=O)O)C1OP(C)(=O)O.[W].
What is the InChIKey of [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten?
The InChIKey is LGKLHNGBNXQFCR-HMEHNGNUSA-N. The full InChI is InChI=1S/C9H19O7P2.W/c1-14-8-5-4-7(6-15-17(2,10)11)9(8)16-18(3,12)13;/h5,7-9H,4,6H2,1-3H3,(H,10,11)(H,12,13);/q-1;/t7-,8-,9?;/m1./s1.
What are the key properties of [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten?
[(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten has a molecular weight of 485.03 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,3R)-2-[hydroxy(methyl)phosphoryl]oxy-3-methoxycyclopentyl]methoxy-methylphosphinic acid;tungsten is sourced from PubChem (CID 58800954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).