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202463-92-1 | 1H-Imidazolium, 3-ethenyl-1-octadecyl-, bromide (1:1)
CAS No: 202463-92-1 Catalog No: AG00288P MDL No:
Product Description
Catalog Number:
AG00288P
Chemical Name:
1H-Imidazolium, 3-ethenyl-1-octadecyl-, bromide (1:1)
CAS Number:
202463-92-1
Molecular Formula:
C23H45BrN2
Molecular Weight:
429.5208
IUPAC Name:
1-ethenyl-3-octadecyl-1,2-dihydroimidazol-1-ium;bromide
InChI:
InChI=1S/C23H44N2.BrH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-22-21-24(4-2)23-25;/h4,21-22H,2-3,5-20,23H2,1H3;1H
InChI Key:
IHYLWOYHSUUGGT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC[NH+]1C=CN(C1)C=C.[Br-]
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
428.277g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
429.531g/mol
Monoisotopic Mass:
428.277g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
7.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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