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789445-30-3 | 1-(4-(Chloromethyl)phenyl)-1H-imidazole
CAS No: 789445-30-3 Catalog No: AG005CUF MDL No:MFCD07352297
Product Description
Catalog Number:
AG005CUF
Chemical Name:
1-(4-(Chloromethyl)phenyl)-1H-imidazole
CAS Number:
789445-30-3
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
MDL Number:
MFCD07352297
IUPAC Name:
1-[4-(chloromethyl)phenyl]imidazole
InChI:
InChI=1S/C10H9ClN2/c11-7-9-1-3-10(4-2-9)13-6-5-12-8-13/h1-6,8H,7H2
InChI Key:
DJAJKNDOAPELFN-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)n1cncc1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.646g/mol
Monoisotopic Mass:
192.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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