Home Nitriles 2-(4-acetylphenoxy)acetonitrile

2-(4-acetylphenoxy)acetonitrile

CAS No.:
160984-14-5
Catalog Number:
AG019HWE
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
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Product Description
Catalog Number:
AG019HWE
Chemical Name:
2-(4-acetylphenoxy)acetonitrile
CAS Number:
160984-14-5
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD03964708
IUPAC Name:
2-(4-acetylphenoxy)acetonitrile
InChI:
InChI=1S/C10H9NO2/c1-8(12)9-2-4-10(5-3-9)13-7-6-11/h2-5H,7H2,1H3
InChI Key:
LMPOOCSNZQWRBX-UHFFFAOYSA-N
SMILES:
N#CCOc1ccc(cc1)C(=O)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties