chempirical

Molybdophosphoric acid (H3Mo12PO40) hydrate

H5Mo12O41PCAS 51429-74-41843.37 g/mol

Open in Covalent MOL file
H2OOPHOHOOHMo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+Mo4+O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−O2−OOOOOOOOOOOO
Phosphate

Properties

Molecular formula
H5Mo12O41P
Molar mass
1843.37 g/mol
Exact mass
1866.6692 Da
logP
-6.06Crippen estimate
Polar surface area
1135.3 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
0

Identifiers

CAS number
51429-74-4
SMILES
O.O=P(O)(O)O.[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[Mo+4].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O].[O].[O].[O].[O].[O].[O].[O].[O].[O].[O].[O]
InChIKey
YBJOGPJTURREAY-UHFFFAOYSA-N
InChI
InChI=1S/12Mo.H3O4P.H2O.36O/c;;;;;;;;;;;;1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;;;;;;;;;;;(H3,1,2,3,4);1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q12*+4;;;;;;;;;;;;;;;24*-2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • Molybdophosphoric acid (H3pmo12O40), hydrate
  • Molybdate(3-), tetracosa-μ-oxododecaoxo[μ12-[phosphato(3-)-κO:κO:κO:κO′:κO′:κO′:κO′′:κO′′:κO′′:κO′′′:κO′′′:κO′′′]]dodeca-, hydrogen, hydrate (1:3:?)
  • Molybdate(3-), tetracosa-μ-oxododecaoxo[μ12-[phosphato(3-)-O:O:O:O′:O′:O′:O′′:O′′:O′′:O′′′:O′′′:O′′′]]dodeca-, trihydrogen, hydrate
  • Molybdophosphoric acid, nonacosahydrate
  • Molybdate(3-), tetracosa-μ-oxododecaoxo[μ12-[phosphato(3-)-κO:κO:κO:κO′:κO′:κO′:κO′′:κO′′:κO′′:κO′′′:κO′′′:κO′′′]]dodeca-, trihydrogen, hydrate
  • Phosphoric acid, molybdenum complex
  • Molybdophosphoric acid (H6P2Mo24O80), hydrate
  • PMA

Work with Molybdophosphoric acid (H3Mo12PO40) hydrate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Molybdate(3-), tetracosa-μ-oxododecaoxo[μ12-[phosphato(3-)-κO:κO:κO:κO′:κO′:κO′:κO′′:κO′′:κO′′:κO′′′:κO′′′:κO′′′]]dodeca-, ammonium, hydrate (1:3:?)54723-94-388 % similar Hydrogen phosphotungstate hydrate (H3PW12O40.xH2O)12501-23-475 % similar Piperazine, phosphate, hydrate (1:1:1)18534-18-444 % similar Phosphoric acid7664-38-243 % similar Sodium phosphomolybdate (na3pmo12O40)1313-30-040 % similar Ammonium phosphate10361-65-638 % similar Zirconium phosphate (zr(hpo4)2)13772-29-738 % similar Ammonium dihydrogen phosphate7722-76-138 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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