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Home > Imidazoles > 1533442-94-2
1533442-94-2 | 2-cyclopropyl-4-iodo-5-methyl-1H-imidazole
CAS No: 1533442-94-2 Catalog No: AG01DHLA MDL No:
Product Description
Catalog Number:
AG01DHLA
Chemical Name:
2-cyclopropyl-4-iodo-5-methyl-1H-imidazole
CAS Number:
1533442-94-2
Molecular Formula:
C7H9IN2
Molecular Weight:
248.0642
IUPAC Name:
2-cyclopropyl-4-iodo-5-methyl-1H-imidazole
InChI:
InChI=1S/C7H9IN2/c1-4-6(8)10-7(9-4)5-2-3-5/h5H,2-3H2,1H3,(H,9,10)
InChI Key:
FOQREEKZOXQNGO-UHFFFAOYSA-N
SMILES:
Ic1nc([nH]c1C)C1CC1
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.981g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.067g/mol
Monoisotopic Mass:
247.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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