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Home > Imidazoles > 89372-21-4
89372-21-4 | 1H-Imidazole, 1-[[1-(2,5-dimethylphenyl)cyclopentyl]carbonyl]-
CAS No: 89372-21-4 Catalog No: AG003YVN MDL No:
Product Description
Catalog Number:
AG003YVN
Chemical Name:
1H-Imidazole, 1-[[1-(2,5-dimethylphenyl)cyclopentyl]carbonyl]-
CAS Number:
89372-21-4
Molecular Formula:
C17H20N2O
Molecular Weight:
268.3535
IUPAC Name:
[1-(2,5-dimethylphenyl)cyclopentyl]-imidazol-1-ylmethanone
InChI:
InChI=1S/C17H20N2O/c1-13-5-6-14(2)15(11-13)17(7-3-4-8-17)16(20)19-10-9-18-12-19/h5-6,9-12H,3-4,7-8H2,1-2H3
InChI Key:
LOXGJKXLZBNWNV-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C1(CCCC1)C(=O)n1cncc1)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.36g/mol
Monoisotopic Mass:
268.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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