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108886-12-0 | 1H-Imidazole, 1-[1-[2-(nonyloxy)phenyl]-1-propenyl]-
CAS No: 108886-12-0 Catalog No: AG007TZ0 MDL No:
Product Description
Catalog Number:
AG007TZ0
Chemical Name:
1H-Imidazole, 1-[1-[2-(nonyloxy)phenyl]-1-propenyl]-
CAS Number:
108886-12-0
Molecular Formula:
C21H30N2O
Molecular Weight:
326.4757
IUPAC Name:
1-[1-(2-nonoxyphenyl)prop-1-enyl]imidazole
InChI:
InChI=1S/C21H30N2O/c1-3-5-6-7-8-9-12-17-24-21-14-11-10-13-19(21)20(4-2)23-16-15-22-18-23/h4,10-11,13-16,18H,3,5-9,12,17H2,1-2H3
InChI Key:
IGKYROUZWLWVRY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCOc1ccccc1C(=CC)n1cncc1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.236g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.484g/mol
Monoisotopic Mass:
326.236g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.3
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