Home Nitriles 4-(aminooxy)benzonitrile

4-(aminooxy)benzonitrile

CAS No.:
94831-79-5
Catalog Number:
AG01ALEC
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
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Product Description
Catalog Number:
AG01ALEC
Chemical Name:
4-(aminooxy)benzonitrile
CAS Number:
94831-79-5
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
MDL Number:
MFCD21921059
IUPAC Name:
4-aminooxybenzonitrile
InChI:
InChI=1S/C7H6N2O/c8-5-6-1-3-7(10-9)4-2-6/h1-4H,9H2
InChI Key:
KJYWSKLWGHSQEP-UHFFFAOYSA-N
SMILES:
NOc1ccc(cc1)C#N
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties