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Home > Imidazoles > 116137-48-5
116137-48-5 | 1H-Imidazole, 1-(2,2-dimethylpropyl)-5-(2-ethoxyphenyl)-
CAS No: 116137-48-5 Catalog No: AG000BPG MDL No:
Product Description
Catalog Number:
AG000BPG
Chemical Name:
1H-Imidazole, 1-(2,2-dimethylpropyl)-5-(2-ethoxyphenyl)-
CAS Number:
116137-48-5
Molecular Formula:
C16H22N2O
Molecular Weight:
258.3587
IUPAC Name:
1-(2,2-dimethylpropyl)-5-(2-ethoxyphenyl)imidazole
InChI:
InChI=1S/C16H22N2O/c1-5-19-15-9-7-6-8-13(15)14-10-17-12-18(14)11-16(2,3)4/h6-10,12H,5,11H2,1-4H3
InChI Key:
UQJSQUPAWUJAJH-UHFFFAOYSA-N
SMILES:
CCOc1ccccc1c1cncn1CC(C)(C)C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.173g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.365g/mol
Monoisotopic Mass:
258.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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