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Home > Imidazoles > 76167-92-5
76167-92-5 | 1H-Imidazole, 1-[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]-
CAS No: 76167-92-5 Catalog No: AG005FEU MDL No:
Product Description
Catalog Number:
AG005FEU
Chemical Name:
1H-Imidazole, 1-[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]-
CAS Number:
76167-92-5
Molecular Formula:
C16H20N2O
Molecular Weight:
256.3428
IUPAC Name:
1-imidazol-1-yl-2-[4-(2-methylpropyl)phenyl]propan-1-one
InChI:
InChI=1S/C16H20N2O/c1-12(2)10-14-4-6-15(7-5-14)13(3)16(19)18-9-8-17-11-18/h4-9,11-13H,10H2,1-3H3
InChI Key:
GWVZUDPPICBVNC-UHFFFAOYSA-N
SMILES:
CC(Cc1ccc(cc1)C(C(=O)n1cncc1)C)C
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.349g/mol
Monoisotopic Mass:
256.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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