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1053657-20-7 | 5-Chloromethyl-2-(4-chlorophenyl)-1H-imidazole
CAS No: 1053657-20-7 Catalog No: AG01F9Z1 MDL No:
Product Description
Catalog Number:
AG01F9Z1
Chemical Name:
5-Chloromethyl-2-(4-chlorophenyl)-1H-imidazole
CAS Number:
1053657-20-7
Molecular Formula:
C10H8Cl2N2
Molecular Weight:
227.0899
IUPAC Name:
5-(chloromethyl)-2-(4-chlorophenyl)-1H-imidazole
InChI:
InChI=1S/C10H8Cl2N2/c11-5-9-6-13-10(14-9)7-1-3-8(12)4-2-7/h1-4,6H,5H2,(H,13,14)
InChI Key:
ZTZALKNSSDQIHI-UHFFFAOYSA-N
SMILES:
ClCc1cnc([nH]1)c1ccc(cc1)Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.006g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.088g/mol
Monoisotopic Mass:
226.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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