5-Hydroperoxymethyluracil structure

5-Hydroperoxymethyluracil

5-(hydroperoxymethyl)-1H-pyrimidine-2,4-dione

Also Known As: alpha-Tooh|5-Hydroperoxymethyluracil|thymine hydroperoxide|Uracil, 5-hydroperoxymethyl-|Uracil,5-hydroperoxymethyl|5-(hydroperoxymethyl)uracil|5-(hydroperoxymethyl)-1H-pyrimidine-2,4-dione|2,4(1H,3H)-Pyrimidinedione, 5-(hydroperoxymethyl)-|5-hydroperoxymethyl-1H-pyrimidine-2,4-dione|5-(hydroperoxymethyl)pyrimidine-2,4(1H,3H)-dione|2,4(1H,3H)-Pyrimidinedione,5-(hydroperoxymethyl)-|5-(hydroperoxymethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS: 33499-50-2
Molecular Formula C5H6N2O4
Molecular Weight 158.03276 g/mol
LogP -2.4
Topological Polar Surface Area 87.7 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 158.03276
Monoisotopic Mass 158.03276
Heavy Atoms 11
Complexity 223.0

Chemical Identifiers

CAS Number 33499-50-2
SMILES C1=C(C(=O)NC(=O)N1)COO
InChIKey MXVRXIGBAGNOJF-UHFFFAOYSA-N

Product Overview

5-Hydroperoxymethyluracil (CAS 33499-50-2), with molecular formula C5H6N2O4 and molecular weight 158.03276 g/mol. IUPAC: 5-(hydroperoxymethyl)-1H-pyrimidine-2,4-dione.

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