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Home > Imidazoles > 89372-35-0
89372-35-0 | 1H-Imidazole, 1-[(1-phenylcyclohexyl)carbonyl]-
CAS No: 89372-35-0 Catalog No: AG003X49 MDL No:
Product Description
Catalog Number:
AG003X49
Chemical Name:
1H-Imidazole, 1-[(1-phenylcyclohexyl)carbonyl]-
CAS Number:
89372-35-0
Molecular Formula:
C16H18N2O
Molecular Weight:
254.3269
IUPAC Name:
imidazol-1-yl-(1-phenylcyclohexyl)methanone
InChI:
InChI=1S/C16H18N2O/c19-15(18-12-11-17-13-18)16(9-5-2-6-10-16)14-7-3-1-4-8-14/h1,3-4,7-8,11-13H,2,5-6,9-10H2
InChI Key:
GTNBWSGCYSIUPX-UHFFFAOYSA-N
SMILES:
O=C(C1(CCCCC1)c1ccccc1)n1cncc1
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.142g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.333g/mol
Monoisotopic Mass:
254.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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