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Home > Imidazoles > 23996-16-9
23996-16-9 | 1-(2-CYANOETHYL)-2-UNDECYLIMIDAZOLE
CAS No: 23996-16-9 Catalog No: AG003CU5 MDL No:
Product Description
Catalog Number:
AG003CU5
Chemical Name:
1-(2-CYANOETHYL)-2-UNDECYLIMIDAZOLE
CAS Number:
23996-16-9
Molecular Formula:
C17H29N3
Molecular Weight:
275.4323
IUPAC Name:
3-(2-undecylimidazol-1-yl)propanenitrile
InChI:
InChI=1S/C17H29N3/c1-2-3-4-5-6-7-8-9-10-12-17-19-14-16-20(17)15-11-13-18/h14,16H,2-12,15H2,1H3
InChI Key:
SZUPZARBRLCVCB-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCc1nccn1CCC#N
EC Number:
245-973-4
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.236g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.44g/mol
Monoisotopic Mass:
275.236g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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