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N-Ethylpropionamide

CAT: 0127-OR924195-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR924195-01Size:100 mg
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CAS Number
5129-72-6
MDL Number
MFCD00059388
Purity
99%
Smiles
CCNC(=O)CC

Chemical Information

N-Ethylpropionamide

structure in first source

CAS Number5129-72-6
PubChem CID521324
IUPAC NameN-ethylpropanamide
Molecular FormulaC5H11NO
Molecular Weight101.15
XLogP0.4
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity61
SMILES
CCC(=O)NCC
InChI
InChI=1S/C5H11NO/c1-3-5(7)6-4-2/h3-4H2,1-2H3,(H,6,7)
InChIKey
ABMDIECEEGFXNC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Ethylpropionamide
CAS: 5129-72-6
CID: 521324
Formula: C5H11NO
MW: 101.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight101.15
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass101.084063974
Monoisotopic Mass101.084063974
Topological Polar Surface Area29.1 Ų
Heavy Atom Count7
Formal Charge0
Complexity61.1
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