2,6-Dinitrophenol
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CAS Number 573-56-8
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Catalog Number io-2271
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Classification Nitro
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Molecular Weight 184.1100
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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 |
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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 |