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Home > Imidazoles > 821005-12-3
821005-12-3 | 1H-Imidazole, 2,2'-(1-butylpentylidene)bis[4,5-dihydro-
CAS No: 821005-12-3 Catalog No: AG008JST MDL No:
Product Description
Catalog Number:
AG008JST
Chemical Name:
1H-Imidazole, 2,2'-(1-butylpentylidene)bis[4,5-dihydro-
CAS Number:
821005-12-3
Molecular Formula:
C15H28N4
Molecular Weight:
264.4096
IUPAC Name:
2-[5-(4,5-dihydro-1H-imidazol-2-yl)nonan-5-yl]-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C15H28N4/c1-3-5-7-15(8-6-4-2,13-16-9-10-17-13)14-18-11-12-19-14/h3-12H2,1-2H3,(H,16,17)(H,18,19)
InChI Key:
KKIXQJIIAYDNKC-UHFFFAOYSA-N
SMILES:
CCCCC(C1=NCCN1)(C1=NCCN1)CCCC
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.231g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.417g/mol
Monoisotopic Mass:
264.231g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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