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Ethyl 3-methoxypropanimidate hydrochloride

CAT: 0127-OR1066454-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1066454-01Size:50 mg
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CAS Number
20914-90-3
MDL Number
MFCD25960871
Purity
85%
Smiles
N=C(OCC)CCOC.[H]Cl

Chemical Information

Ethyl 3-methoxypropanimidate hydrochloride
CAS Number20914-90-3
PubChem CID86200540
IUPAC Nameethyl 3-methoxypropanimidate;hydrochloride
Molecular FormulaC6H14ClNO2
Molecular Weight167.63
Topological Polar Surface Area42.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count10
Formal Charge0
Complexity83
SMILES
CCOC(=N)CCOC.Cl
InChI
InChI=1S/C6H13NO2.ClH/c1-3-9-6(7)4-5-8-2;/h7H,3-5H2,1-2H3;1H
InChIKey
CXONETCWAPADEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 3-methoxypropanimidate hydrochloride
CAS: 20914-90-3
CID: 86200540
Formula: C6H14ClNO2
MW: 167.63
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight167.63
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass167.0713064
Monoisotopic Mass167.0713064
Topological Polar Surface Area42.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity83.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes