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Home > Imidazoles > 83184-45-6
83184-45-6 | Methanimidamide, N-[4-(1H-imidazol-4-yl)phenyl]-N'-2-propenyl-
CAS No: 83184-45-6 Catalog No: AG0050DQ MDL No:
Product Description
Catalog Number:
AG0050DQ
Chemical Name:
Methanimidamide, N-[4-(1H-imidazol-4-yl)phenyl]-N'-2-propenyl-
CAS Number:
83184-45-6
Molecular Formula:
C13H14N4
Molecular Weight:
226.2771
IUPAC Name:
N-[4-(1H-imidazol-5-yl)phenyl]-N'-prop-2-enylmethanimidamide
InChI:
InChI=1S/C13H14N4/c1-2-7-14-9-16-12-5-3-11(4-6-12)13-8-15-10-17-13/h2-6,8-10H,1,7H2,(H,14,16)(H,15,17)
InChI Key:
LOKQDUJIZKOTDN-UHFFFAOYSA-N
SMILES:
C=CCN=CNc1ccc(cc1)c1nc[nH]c1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.283g/mol
Monoisotopic Mass:
226.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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