chempirical

Sodium 2-naphthalenyl phosphate (1:1)

C10H8NaO4PCAS 14463-68-4246.13 g/mol

Open in Covalent MOL file
O−POHOONa+
Phosphate

Properties

Molecular formula
C10H8NaO4P
Molar mass
246.13 g/mol
Exact mass
246.0058 Da
logP
1.93Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
14463-68-4
SMILES
[O-]P(=O)(O)Oc1ccc2ccccc2c1.[Na+]
InChIKey
PCIHXKUPWAAROX-UHFFFAOYSA-N
InChI
InChI=1S/C10H9O4P.Na/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H2,11,12,13);

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

Names and synonyms

3 names
  • 2-Naphthalenol, 2-(dihydrogen phosphate), sodium salt (1:1)
  • 2-Naphthol, dihydrogen phosphate monosodium salt
  • 2-Naphthalenol, dihydrogen phosphate, monosodium salt

Work with Sodium 2-naphthalenyl phosphate (1:1)

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

2-Naphthyl ether613-80-943 % similar 1-Naphthyl disodium orthophosphate2183-17-742 % similar Disodium phenyl phosphate3279-54-740 % similar β-Naphthol methyl ether93-04-939 % similar (±)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate35193-63-639 % similar (+)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate35193-64-739 % similar (-)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate39648-67-439 % similar Sodium 2-naphthalenesulfonate532-02-538 % similar

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

Elsewhere

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