Home Nitriles 4-[(4-aminonaphthalen-1-yl)oxy]butanenitrile

4-[(4-aminonaphthalen-1-yl)oxy]butanenitrile

CAS No.:
1394042-68-2
Catalog Number:
AG019ZNL
Molecular Formula:
C14H14N2O
Molecular Weight:
226.2738
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Product Description
Catalog Number:
AG019ZNL
Chemical Name:
4-[(4-aminonaphthalen-1-yl)oxy]butanenitrile
CAS Number:
1394042-68-2
Molecular Formula:
C14H14N2O
Molecular Weight:
226.2738
MDL Number:
MFCD18998450
IUPAC Name:
4-(4-aminonaphthalen-1-yl)oxybutanenitrile
InChI:
InChI=1S/C14H14N2O/c15-9-3-4-10-17-14-8-7-13(16)11-5-1-2-6-12(11)14/h1-2,5-8H,3-4,10,16H2
InChI Key:
KLCSOYSBIDXZQD-UHFFFAOYSA-N
SMILES:
N#CCCCOc1ccc(c2c1cccc2)N
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.111g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.279g/mol
Monoisotopic Mass:
226.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties