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O-(2,4-Dinitrophenyl)hydroxylamine

CAT: 0572-TRC-D479985-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D479985-1GSize:1 g
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CAS Number
17508-17-7
Synonyms
1-Aminooxy-2,4-dinitrobenzene; 2,4-Dinitrophenoxyamine; 2,4-Nitrophenoxyamine; DNPA; NSC 148499;
Hazard Statement
Harmful if swallowed; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ON
Molecular Formula
C6H5N3O5
Molecular Weight
199.12
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

O-(2,4-dinitrophenyl)hydroxylamine

structure given in first source

CAS Number17508-17-7
PubChem CID87140
IUPAC NameO-(2,4-dinitrophenyl)hydroxylamine
Molecular FormulaC6H5N3O5
Molecular Weight199.12
XLogP0.7
Topological Polar Surface Area127
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity235
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ON
InChI
InChI=1S/C6H5N3O5/c7-14-6-2-1-4(8(10)11)3-5(6)9(12)13/h1-3H,7H2
InChIKey
YLACRFYIUQZNIV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of O-(2,4-dinitrophenyl)hydroxylamine
CAS: 17508-17-7
CID: 87140
Formula: C6H5N3O5
MW: 199.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight199.12
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass199.02292027
Monoisotopic Mass199.02292027
Topological Polar Surface Area127 Ų
Heavy Atom Count14
Formal Charge0
Complexity235
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
FD22435-01O- (2,4-Dinitrophenyl) hydroxylamine
MBS6045727-01O-(2,4-Dinitrophenyl)hydroxylamine
RIA06766-01O- (2,4-Dimethoxybenzyl) hydroxylamine
FN71679O- (4-Nitrobenzoyl) hydroxylamine
FN143791-01O- (4-Nitrophenyl) hydroxylamine
RG-A263385-01O- (4-Methoxybenzyl) Hydroxylamine
OR75411-01O- (4-nitrobenzyl) hydroxylamine
PC1002406-01O- (4-Fluorobenzyl) hydroxylamine
PC111546-01O-[ (2,4-difluorophenyl) methyl]hydroxylamine
abx184287-01O-(4-Nitrobenzoyl)hydroxylamine

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