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89372-09-8 | 1H-Imidazole, 1-[[1-(2,4-dichlorophenyl)cyclobutyl]carbonyl]-
CAS No: 89372-09-8 Catalog No: AG003YVQ MDL No:
Product Description
Catalog Number:
AG003YVQ
Chemical Name:
1H-Imidazole, 1-[[1-(2,4-dichlorophenyl)cyclobutyl]carbonyl]-
CAS Number:
89372-09-8
Molecular Formula:
C14H12Cl2N2O
Molecular Weight:
295.1639
IUPAC Name:
[1-(2,4-dichlorophenyl)cyclobutyl]-imidazol-1-ylmethanone
InChI:
InChI=1S/C14H12Cl2N2O/c15-10-2-3-11(12(16)8-10)14(4-1-5-14)13(19)18-7-6-17-9-18/h2-3,6-9H,1,4-5H2
InChI Key:
VDDYUFHHGRELFA-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)C1(CCC1)C(=O)n1cncc1
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.033g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.163g/mol
Monoisotopic Mass:
294.033g/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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