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Home > Imidazoles > 654653-22-2
654653-22-2 | 1H-Imidazole, 5-[4-(hexyloxy)phenyl]-1-(phenylmethyl)-
CAS No: 654653-22-2 Catalog No: AG006Q5V MDL No:
Product Description
Catalog Number:
AG006Q5V
Chemical Name:
1H-Imidazole, 5-[4-(hexyloxy)phenyl]-1-(phenylmethyl)-
CAS Number:
654653-22-2
Molecular Formula:
C22H26N2O
Molecular Weight:
334.4546
IUPAC Name:
1-benzyl-5-(4-hexoxyphenyl)imidazole
InChI:
InChI=1S/C22H26N2O/c1-2-3-4-8-15-25-21-13-11-20(12-14-21)22-16-23-18-24(22)17-19-9-6-5-7-10-19/h5-7,9-14,16,18H,2-4,8,15,17H2,1H3
InChI Key:
FQHUQMZXBGFCGQ-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(cc1)c1cncn1Cc1ccccc1
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.205g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.463g/mol
Monoisotopic Mass:
334.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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