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2,4-Dinitrophenol

CAT: 0203-13518-82Size: 25 gDry Ice: NoHazardous: Yes
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CAT#:0203-13518-82Size:25 g
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CAS Number
51-28-5
Storage Conditions
Room temperature

Chemical Information

2,4-Dinitrophenol

2,4-dinitrophenol is a dinitrophenol having the nitro groups at the 2- and 4-positions. It has a role as a geroprotector, an antiseptic drug, an allergen, an oxidative phosphorylation inhibitor and a bacterial xenobiotic metabolite. It is a conjugate acid of a 2,4-dinitrophenol(1-).

CAS Number51-28-5
PubChem CID1493
IUPAC Name2,4-dinitrophenol
Molecular FormulaC6H4N2O5
Molecular Weight184.11
XLogP1.7
Topological Polar Surface Area112
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity220
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O
InChI
InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
InChIKey
UFBJCMHMOXMLKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4-Dinitrophenol
CAS: 51-28-5
CID: 1493
Formula: C6H4N2O5
MW: 184.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.11
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass184.01202123
Monoisotopic Mass184.01202123
Topological Polar Surface Area112 Ų
Heavy Atom Count13
Formal Charge0
Complexity220
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-D479949-2.5MG2,4-Dinitrophenol-13C6
TRC-D479947-50MG2,4-Dinitrophenol-d3
D47590-012,4-Dinitrophenol 98%
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DCA55950-014-Methanesulfonyl-2,6-dinitrophenol
QBA46695-014-Bromo-2,6-dinitrophenol
TRC-M342690-10MG4-methyl-2,5-dinitrophenol
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