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19224-31-8

19224-31-8 | Benzonitrile, 4-[[[4-(dimethylamino)phenyl]imino]methyl]-

CAS No: 19224-31-8 Catalog No: AG002FS6 MDL No:

Product Description

Catalog Number:
AG002FS6
Chemical Name:
Benzonitrile, 4-[[[4-(dimethylamino)phenyl]imino]methyl]-
CAS Number:
19224-31-8
Molecular Formula:
C16H15N3
Molecular Weight:
249.3104
IUPAC Name:
4-[[4-(dimethylamino)phenyl]iminomethyl]benzonitrile
InChI:
InChI=1S/C16H15N3/c1-19(2)16-9-7-15(8-10-16)18-12-14-5-3-13(11-17)4-6-14/h3-10,12H,1-2H3
InChI Key:
VZILFTBPXRBPHN-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C=Nc1ccc(cc1)N(C)C

Properties

Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.127g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.317g/mol
Monoisotopic Mass:
249.127g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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