trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium

C2H7O7P2+ — CID 56626308

IUPACtrihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium
SMILESCOP(=O)(O)C(=O)[P+](O)(O)O
InChIInChI=1S/C2H6O7P2/c1-9-11(7,8)2(3)10(4,5)6/h4-6H,1H3/p+1
InChIKeyOBIQOGBESYDNMD-UHFFFAOYSA-O
MW205.02 g/mol
LogP-0.32
Rot. Bonds3

About trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium

trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium (PubChem CID 56626308) has the molecular formula C2H7O7P2+ and a molecular weight of 205.02 g/mol. Its IUPAC name is trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium.

Molecular Properties

Compound Nametrihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium
PubChem CID56626308
Molecular FormulaC2H7O7P2+
Molecular Weight205.02 g/mol
Exact Mass204.97
IUPAC Nametrihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium
SMILESCOP(=O)(O)C(=O)[P+](O)(O)O
InChIInChI=1S/C2H6O7P2/c1-9-11(7,8)2(3)10(4,5)6/h4-6H,1H3/p+1
InChIKeyOBIQOGBESYDNMD-UHFFFAOYSA-O
XLogP-0.32
TPSA124.29 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.02
LogP ≤ 5-0.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[ethenoxy(hydroxy)phosphoryl]carbonyl-trihydroxyphosphanium
CID 56634520
methoxy(oxaldehydoyl)phosphinic acid
CID 87673316
tetrasodium;hydride;tetrakis([hydroxy-[hydroxy(methoxy)phosphoryl]methyl]phosphonic acid)
CID 173412667
diethoxyphosphorylcarbonyl(trihydroxy)phosphanium
CID 57080631
carbanylium;methyl dihydrogen phosphate
CID 165007935
potassium;hydride;phosphoric acid;trimethyl phosphate
CID 174889020
1,1-dihydroxypropan-2-one;phosphono dihydrogen phosphate;phosphoric acid
CID 88683784
formaldehyde;bis(methyl dihydrogen phosphate)
CID 174780160
tris(dimethyl hydrogen phosphate);titanium
CID 131876605
fluoro(methoxy)phosphinic acid
CID 23235630
cobalt;methyl dihydrogen phosphate;nickel
CID 175031346
dipotassium;hydride;methyl dihydrogen phosphate
CID 174980148

Frequently Asked Questions

What is the IUPAC name of trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium?
The IUPAC name of trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium (CID 56626308) is trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium.
What is the SMILES notation for trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium?
The canonical SMILES for trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium is COP(=O)(O)C(=O)[P+](O)(O)O.
What is the InChIKey of trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium?
The InChIKey is OBIQOGBESYDNMD-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H6O7P2/c1-9-11(7,8)2(3)10(4,5)6/h4-6H,1H3/p+1.
What are the key properties of trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium?
trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium has a molecular weight of 205.02 g/mol, XLogP of -0.32, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium is sourced from PubChem (CID 56626308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).