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941286-76-6 | 1-Benzyl-5-iodo-1H-imidazole
CAS No: 941286-76-6 Catalog No: AG003E07 MDL No:MFCD23381124
Product Description
Catalog Number:
AG003E07
Chemical Name:
1-Benzyl-5-iodo-1H-imidazole
CAS Number:
941286-76-6
Molecular Formula:
C10H9IN2
Molecular Weight:
284.0963
MDL Number:
MFCD23381124
IUPAC Name:
1-benzyl-5-iodoimidazole
InChI:
InChI=1S/C10H9IN2/c11-10-6-12-8-13(10)7-9-4-2-1-3-5-9/h1-6,8H,7H2
InChI Key:
LJUFISVVTYNDGH-UHFFFAOYSA-N
SMILES:
Ic1cncn1Cc1ccccc1
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.981g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.1g/mol
Monoisotopic Mass:
283.981g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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