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1- (2-Methoxyethyl) guanidine

CAT: 0127-OR1044896-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1044896-01Size:100 mg
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CAS Number
108712-07-8
MDL Number
MFCD11505279
Purity
95%
Smiles
NC(NCCOC)=N

Chemical Information

1-(2-Methoxyethyl)guanidine
CAS Number108712-07-8
PubChem CID13805823
IUPAC Name2-(2-methoxyethyl)guanidine
Molecular FormulaC4H11N3O
Molecular Weight117.15
XLogP-1.5
Topological Polar Surface Area73.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity77
SMILES
COCCN=C(N)N
InChI
InChI=1S/C4H11N3O/c1-8-3-2-7-4(5)6/h2-3H2,1H3,(H4,5,6,7)
InChIKey
XNPSFFSMEXSPKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(2-Methoxyethyl)guanidine
CAS: 108712-07-8
CID: 13805823
Formula: C4H11N3O
MW: 117.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight117.15
XLogP3-1.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass117.090211983
Monoisotopic Mass117.090211983
Topological Polar Surface Area73.6 Ų
Heavy Atom Count8
Formal Charge0
Complexity77.4
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-329128N- (2-Methoxyethyl) guanidine compound with sulfuric acid (2:1)
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