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144693-27-6 | 1H-Imidazole, 1-[[4-(1H-pyrrol-1-ylmethyl)phenyl]methyl]-
CAS No: 144693-27-6 Catalog No: AG001K0S MDL No:
Product Description
Catalog Number:
AG001K0S
Chemical Name:
1H-Imidazole, 1-[[4-(1H-pyrrol-1-ylmethyl)phenyl]methyl]-
CAS Number:
144693-27-6
Molecular Formula:
C15H15N3
Molecular Weight:
237.2997
IUPAC Name:
1-[[4-(pyrrol-1-ylmethyl)phenyl]methyl]imidazole
InChI:
InChI=1S/C15H15N3/c1-2-9-17(8-1)11-14-3-5-15(6-4-14)12-18-10-7-16-13-18/h1-10,13H,11-12H2
InChI Key:
FEPUHMADAWVOCQ-UHFFFAOYSA-N
SMILES:
c1ccn(c1)Cc1ccc(cc1)Cn1cncc1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.306g/mol
Monoisotopic Mass:
237.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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