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Home > Imidazoles > 108886-10-8
108886-10-8 | 1H-Imidazole, 1-[1-[2-(octyloxy)phenyl]-1-propenyl]-
CAS No: 108886-10-8 Catalog No: AG00831A MDL No:
Product Description
Catalog Number:
AG00831A
Chemical Name:
1H-Imidazole, 1-[1-[2-(octyloxy)phenyl]-1-propenyl]-
CAS Number:
108886-10-8
Molecular Formula:
C20H28N2O
Molecular Weight:
312.4491
IUPAC Name:
1-[1-(2-octoxyphenyl)prop-1-enyl]imidazole
InChI:
InChI=1S/C20H28N2O/c1-3-5-6-7-8-11-16-23-20-13-10-9-12-18(20)19(4-2)22-15-14-21-17-22/h4,9-10,12-15,17H,3,5-8,11,16H2,1-2H3
InChI Key:
RSWIOJGAFGZTGU-UHFFFAOYSA-N
SMILES:
CCCCCCCCOc1ccccc1C(=CC)n1cncc1
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.22g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.457g/mol
Monoisotopic Mass:
312.22g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.8
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