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2- (4-nitrophenoxy) propanohydrazide

CAT: 0024-sc-282696Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-282696Size:100 mg
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CAS Number
203741-61-1

Chemical Information

2-(4-Nitrophenoxy)propanohydrazide
CAS Number203741-61-1
PubChem CID3727013
IUPAC Name2-(4-nitrophenoxy)propanehydrazide
Molecular FormulaC9H11N3O4
Molecular Weight225.20
XLogP0.7
Topological Polar Surface Area110
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity258
SMILES
CC(C(=O)NN)OC1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C9H11N3O4/c1-6(9(13)11-10)16-8-4-2-7(3-5-8)12(14)15/h2-6H,10H2,1H3,(H,11,13)
InChIKey
PMNXIBGQTSSNCB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Nitrophenoxy)propanohydrazide
CAS: 203741-61-1
CID: 3727013
Formula: C9H11N3O4
MW: 225.20
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight225.20
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass225.07495584
Monoisotopic Mass225.07495584
Topological Polar Surface Area110 Ų
Heavy Atom Count16
Formal Charge0
Complexity258
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes