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89220-68-8 | 1H-Imidazole, 1-[2-(4-chlorophenyl)-2-propenyl]-
CAS No: 89220-68-8 Catalog No: AG0044YJ MDL No:
Product Description
Catalog Number:
AG0044YJ
Chemical Name:
1H-Imidazole, 1-[2-(4-chlorophenyl)-2-propenyl]-
CAS Number:
89220-68-8
Molecular Formula:
C12H11ClN2
Molecular Weight:
218.6821
IUPAC Name:
1-[2-(4-chlorophenyl)prop-2-enyl]imidazole
InChI:
InChI=1S/C12H11ClN2/c1-10(8-15-7-6-14-9-15)11-2-4-12(13)5-3-11/h2-7,9H,1,8H2
InChI Key:
SCBZLYHZFYCHRW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(=C)Cn1cncc1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.061g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.684g/mol
Monoisotopic Mass:
218.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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