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N-Nitroso N-Ethylethylenediamine

CAT: 1596-AR-M05088-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-M05088-01Size:10 Units
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CAS Number
2680539-26-6
Synonyms
N- (2-Aminoethyl) -N-ethylnitrous amide
Molecular Formula
C4H11N3O
Molecular Weight
117.15
API Name
Morantel

Chemical Information

N-(2-aminoethyl)-N-ethylnitrous amide
CAS Number2680539-26-6
PubChem CID165940518
IUPAC NameN-(2-aminoethyl)-N-ethylnitrous amide
Molecular FormulaC4H11N3O
Molecular Weight117.15
XLogP-0.4
Topological Polar Surface Area58.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity66
SMILES
CCN(CCN)N=O
InChI
InChI=1S/C4H11N3O/c1-2-7(6-8)4-3-5/h2-5H2,1H3
InChIKey
AEQYGACQMJFSEU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-aminoethyl)-N-ethylnitrous amide
CAS: 2680539-26-6
CID: 165940518
Formula: C4H11N3O
MW: 117.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight117.15
XLogP3-0.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass117.090211983
Monoisotopic Mass117.090211983
Topological Polar Surface Area58.7 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.3
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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