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Home > Imidazoles > 83184-33-2
83184-33-2 | Methanimidamide, N-cyano-N'-[3-(1H-imidazol-4-yl)phenyl]-
CAS No: 83184-33-2 Catalog No: AG004VOM MDL No:
Product Description
Catalog Number:
AG004VOM
Chemical Name:
Methanimidamide, N-cyano-N'-[3-(1H-imidazol-4-yl)phenyl]-
CAS Number:
83184-33-2
Molecular Formula:
C11H9N5
Molecular Weight:
211.2227
IUPAC Name:
N-cyano-N'-[3-(1H-imidazol-5-yl)phenyl]methanimidamide
InChI:
InChI=1S/C11H9N5/c12-6-14-8-15-10-3-1-2-9(4-10)11-5-13-7-16-11/h1-5,7-8H,(H,13,16)(H,14,15)
InChI Key:
XLMBSFCAWMVQRC-UHFFFAOYSA-N
SMILES:
N#CNC=Nc1cccc(c1)c1c[nH]cn1
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.086g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.228g/mol
Monoisotopic Mass:
211.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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