1H-Imidazole-2-carboxaldehyde, 1-ethyl-


Chemical Name: 1H-Imidazole-2-carboxaldehyde, 1-ethyl-
CAS Number: 111851-98-0
Product Number: AG008Z1J(AGN-PC-0NF9C0)
Synonyms:
MDL No:
Molecular Formula: C6H8N2O
Molecular Weight: 124.1405

Identification/Properties


Computed Properties
Molecular Weight:
124.143g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
124.064g/mol
Monoisotopic Mass:
124.064g/mol
Topological Polar Surface Area:
34.9A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
105
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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