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132184-54-4 | Benzonitrile, 4-[(E)-[(4-methylphenyl)methylene]amino]-
CAS No: 132184-54-4 Catalog No: AG0010C8 MDL No:
Product Description
Catalog Number:
AG0010C8
Chemical Name:
Benzonitrile, 4-[(E)-[(4-methylphenyl)methylene]amino]-
CAS Number:
132184-54-4
Molecular Formula:
C15H12N2
Molecular Weight:
220.2692
IUPAC Name:
4-[(4-methylphenyl)methylideneamino]benzonitrile
InChI:
InChI=1S/C15H12N2/c1-12-2-4-14(5-3-12)11-17-15-8-6-13(10-16)7-9-15/h2-9,11H,1H3
InChI Key:
UQBQQMKBXSJPDJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)/N=C/c1ccc(cc1)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.275g/mol
Monoisotopic Mass:
220.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Isostructuralism among bridge-flipped' isomeric benzylideneanilines and phenylhydrazones. | Acta crystallographica. Section B, Structural science 20070601 |
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