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Home > Aldehydes > 1368217-81-5
1368217-81-5 | 4-ethyl-1H-imidazole-2-carbaldehyde
CAS No: 1368217-81-5 Catalog No: AG01B5AJ MDL No:MFCD14583748
Product Description
Catalog Number:
AG01B5AJ
Chemical Name:
4-ethyl-1H-imidazole-2-carbaldehyde
CAS Number:
1368217-81-5
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD14583748
IUPAC Name:
5-ethyl-1H-imidazole-2-carbaldehyde
InChI:
InChI=1S/C6H8N2O/c1-2-5-3-7-6(4-9)8-5/h3-4H,2H2,1H3,(H,7,8)
InChI Key:
BYFFEYKNQDHJJS-UHFFFAOYSA-N
SMILES:
CCc1c[nH]c(n1)C=O
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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