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2D Structure

Diphosphoric Acid


  • SKU Code: CH139070
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Chemical Name - Diphosphoric Acid
Mol Weight - 177.973
Smiles - OP(O)(OP(O)(O)=O)=O
Property Name Property Value
Mol NameDiphosphoric Acid
Molweight177.973
Monoisotopic Mass177.943229
Clogp-7.497
Clogs3.034
H Acceptors7
H Donors4
Total Surface Area96.44
Relative Psa1
Polar Surface Area143.91
Druglikeness-15.717
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.55556
Molecular Flexibility0.8346
Molecular Complexity0.54931
Fragments1
Non H Atoms9
Non Ch Atoms9
Electronegative Atoms9
Rotatable Bonds2
Sp3 Atoms7
Symmetric Atoms5
Acidic Oxygens4
SmilesOP(O)(OP(O)(O)=O)=O
InChIKeyInChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)
InChIXPPKVPWEQAFLFU-UHFFFAOYSA-N

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