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4-nitro- Morpholine

CAT: 0926-EAA16432-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0926-EAA16432-01Size:10 mg
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CAS Number
4164-32-3
MDL Number
MFCD00181688
Smiles
O=N (=O) N1CCOCC1
Molecular Formula
C4H8N2O3
Molecular Weight
132.12 g/mol
Controlled
No

Chemical Information

4-Nitromorpholine
CAS Number4164-32-3
PubChem CID20122
IUPAC Name4-nitromorpholine
Molecular FormulaC4H8N2O3
Molecular Weight132.12
XLogP0.3
Topological Polar Surface Area58.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity105
SMILES
C1COCCN1[N+](=O)[O-]
InChI
InChI=1S/C4H8N2O3/c7-6(8)5-1-3-9-4-2-5/h1-4H2
InChIKey
YZXKWVREBLYPID-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Nitromorpholine
CAS: 4164-32-3
CID: 20122
Formula: C4H8N2O3
MW: 132.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight132.12
XLogP30.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass132.05349212
Monoisotopic Mass132.05349212
Topological Polar Surface Area58.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity105
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