Home Nitriles 2-{[2-(methoxymethyl)phenyl]amino}benzonitrile

2-{[2-(methoxymethyl)phenyl]amino}benzonitrile

CAS No.:
1275714-59-4
Catalog Number:
AG01A2UM
Molecular Formula:
C15H14N2O
Molecular Weight:
238.2845
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Product Description
Catalog Number:
AG01A2UM
Chemical Name:
2-{[2-(methoxymethyl)phenyl]amino}benzonitrile
CAS Number:
1275714-59-4
Molecular Formula:
C15H14N2O
Molecular Weight:
238.2845
MDL Number:
MFCD16190258
IUPAC Name:
2-[2-(methoxymethyl)anilino]benzonitrile
InChI:
InChI=1S/C15H14N2O/c1-18-11-13-7-3-5-9-15(13)17-14-8-4-2-6-12(14)10-16/h2-9,17H,11H2,1H3
InChI Key:
SHVKWXJRQFZITL-UHFFFAOYSA-N
SMILES:
COCc1ccccc1Nc1ccccc1C#N
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.111g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.29g/mol
Monoisotopic Mass:
238.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties