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N-Nitroso Thiomorpholine

CAT: 1596-AR-M05119-05Size: 150Dry Ice: NoHazardous: No
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CAT#:1596-AR-M05119-05Size:150
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CAS Number
26541-51-5
Synonyms
4-nitrosothiomorpholine
Molecular Formula
C4H8N2OS
Molecular Weight
132.18
API Name
Morpholine

Chemical Information

N-Nitrosothiomorpholine
CAS Number26541-51-5
PubChem CID33535
IUPAC Name4-nitrosothiomorpholine
Molecular FormulaC4H8N2OS
Molecular Weight132.19
XLogP0.4
Topological Polar Surface Area58
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity82
SMILES
C1CSCCN1N=O
InChI
InChI=1S/C4H8N2OS/c7-5-6-1-3-8-4-2-6/h1-4H2
InChIKey
OMDNEQQMLDYBTR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Nitrosothiomorpholine
CAS: 26541-51-5
CID: 33535
Formula: C4H8N2OS
MW: 132.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight132.19
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass132.03573406
Monoisotopic Mass132.03573406
Topological Polar Surface Area58 Ų
Heavy Atom Count8
Formal Charge0
Complexity82.1
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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