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Home > Imidazoles > 918643-51-3
918643-51-3 | 1-ethyl-4-iodo-1H-imidazole
CAS No: 918643-51-3 Catalog No: AG01B9I2 MDL No:MFCD28132380
Product Description
Catalog Number:
AG01B9I2
Chemical Name:
1-ethyl-4-iodo-1H-imidazole
CAS Number:
918643-51-3
Molecular Formula:
C5H7IN2
Molecular Weight:
222.0269
MDL Number:
MFCD28132380
IUPAC Name:
1-ethyl-4-iodoimidazole
InChI:
InChI=1S/C5H7IN2/c1-2-8-3-5(6)7-4-8/h3-4H,2H2,1H3
InChI Key:
UMAIWQFKZWNINP-UHFFFAOYSA-N
SMILES:
CCn1cnc(c1)I
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.965g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.029g/mol
Monoisotopic Mass:
221.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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