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138832-80-1 | Pyridine, 1,2-dihydro-2-[2-(2H-imidazol-2-ylidene)ethylidene]-1-methyl-
CAS No: 138832-80-1 Catalog No: AG0019NQ MDL No:
Product Description
Catalog Number:
AG0019NQ
Chemical Name:
Pyridine, 1,2-dihydro-2-[2-(2H-imidazol-2-ylidene)ethylidene]-1-methyl-
CAS Number:
138832-80-1
Molecular Formula:
C11H11N3
Molecular Weight:
185.2251
IUPAC Name:
2-(2-imidazol-2-ylideneethylidene)-1-methylpyridine
InChI:
InChI=1S/C11H11N3/c1-14-9-3-2-4-10(14)5-6-11-12-7-8-13-11/h2-9H,1H3
InChI Key:
RDUIYIJHBHXJSE-UHFFFAOYSA-N
SMILES:
Cn1ccccc1=CC=C1N=CC=N1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.23g/mol
Monoisotopic Mass:
185.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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