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2- (2-Nitrophenyl) acetohydrazide

CAT: 0127-OR96460-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR96460-01Size:5 g
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CAS Number
114953-81-0
MDL Number
MFCD03423205
Purity
98%
Smiles
NNC(CC1=CC=CC=C1[N+]([O-])=O)=O

Chemical Information

2-(2-Nitrophenyl)acetohydrazide
CAS Number114953-81-0
PubChem CID5190869
IUPAC Name2-(2-nitrophenyl)acetohydrazide
Molecular FormulaC8H9N3O3
Molecular Weight195.18
XLogP0.6
Topological Polar Surface Area101
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity226
SMILES
C1=CC=C(C(=C1)CC(=O)NN)[N+](=O)[O-]
InChI
InChI=1S/C8H9N3O3/c9-10-8(12)5-6-3-1-2-4-7(6)11(13)14/h1-4H,5,9H2,(H,10,12)
InChIKey
QCRHPUBNFOAAFJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Nitrophenyl)acetohydrazide
CAS: 114953-81-0
CID: 5190869
Formula: C8H9N3O3
MW: 195.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.18
XLogP30.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass195.06439116
Monoisotopic Mass195.06439116
Topological Polar Surface Area101 Ų
Heavy Atom Count14
Formal Charge0
Complexity226
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
sc-2825162- (2-nitrophenyl) acetohydrazide
sc-2826982- (4-nitrophenyl) acetohydrazide
sc-320889A2- (4-Methoxy-3-nitrophenyl) acetohydrazide
sc-3208192- (4-Hydroxy-3-nitrophenyl) acetohydrazide
sc-287640A2-[ (3-nitrophenyl) amino]-N'-[ (1E) -2-thienylmethylene]acetohydrazide
FM123504-012- (Methylamino) acetohydrazide
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