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Home > Imidazoles > 4238-71-5
4238-71-5 | 1-Benzyl-1H-imidazole
CAS No: 4238-71-5 Catalog No: AG003B13 MDL No:MFCD00005296
Product Description
Catalog Number:
AG003B13
Chemical Name:
1-Benzyl-1H-imidazole
CAS Number:
4238-71-5
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD00005296
IUPAC Name:
1-benzylimidazole
InChI:
InChI=1S/C10H10N2/c1-2-4-10(5-3-1)8-12-7-6-11-9-12/h1-7,9H,8H2
InChI Key:
KKKDZZRICRFGSD-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cn1cncc1
EC Number:
224-200-4
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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