2,6-Dinitrophenol
  • CAS Number 573-56-8
  • Catalog Number io-2271
  • Classification Nitro
  • Molecular Weight 184.1100
  • SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]
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2,6-dinitrophenol is a dinitrophenol.

1 2,6-DINITROPHENOL
2 o-Dinitrophenol
3 Phenol, 2,6-dinitro-
4 beta-Dinitrophenol
5 2,6-DNP
Molecular Formula C6H4N2O5
Canonical SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]
Isomeric SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]
Molecular Weight 184.1100
InChIKey JCRIDWXIBSEOEG-UHFFFAOYSA-N
InChI InChI=1S/C6H4N2O5/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,9H
XLogP 1.4000
ExactMass 184.0120
MonoisotopicMass 184.0120
TPSA 112.0000
Complexity 198.0000
Charge 0.0000
HBondDonorCount 1
HBondAcceptorCount 5
RotatableBondCount 0
HeavyAtomCount 13
IsotopeAtomCount 0
AtomStereoCount 0
DefinedAtomStereoCount 0
UndefinedAtomStereoCount 0
BondStereoCount 0
DefinedBondStereoCount 0
UndefinedBondStereoCount 0
CovalentUnitCount 1
PatentCount 1419
PatentFamilyCount 535
LiteratureCount 276