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Home > Imidazoles > 89197-34-2
89197-34-2 | 1H-Imidazole, 2-(2,3-dihydro-2-pentyl-2-benzofuranyl)-4,5-dihydro-
CAS No: 89197-34-2 Catalog No: AG003VZ7 MDL No:
Product Description
Catalog Number:
AG003VZ7
Chemical Name:
1H-Imidazole, 2-(2,3-dihydro-2-pentyl-2-benzofuranyl)-4,5-dihydro-
CAS Number:
89197-34-2
Molecular Formula:
C16H22N2O
Molecular Weight:
258.3587
IUPAC Name:
2-(2-pentyl-3H-1-benzofuran-2-yl)-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C16H22N2O/c1-2-3-6-9-16(15-17-10-11-18-15)12-13-7-4-5-8-14(13)19-16/h4-5,7-8H,2-3,6,9-12H2,1H3,(H,17,18)
InChI Key:
BDBXIMFUYSLOAH-UHFFFAOYSA-N
SMILES:
CCCCCC1(Cc2c(O1)cccc2)C1=NCCN1
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.173g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.365g/mol
Monoisotopic Mass:
258.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
33.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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