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260050-43-9 | 1H-Imidazole, 5-heptyl-
CAS No: 260050-43-9 Catalog No: AG002RD0 MDL No:
Product Description
Catalog Number:
AG002RD0
Chemical Name:
1H-Imidazole, 5-heptyl-
CAS Number:
260050-43-9
Molecular Formula:
C10H18N2
Molecular Weight:
166.2633
IUPAC Name:
5-heptyl-1H-imidazole
InChI:
InChI=1S/C10H18N2/c1-2-3-4-5-6-7-10-8-11-9-12-10/h8-9H,2-7H2,1H3,(H,11,12)
InChI Key:
DGQRKRRQEVBDKW-UHFFFAOYSA-N
SMILES:
CCCCCCCc1[nH]cnc1
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.147g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.268g/mol
Monoisotopic Mass:
166.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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