Home Nitriles 3-(3-formylphenoxymethyl)benzonitrile

3-(3-formylphenoxymethyl)benzonitrile

CAS No.:
928708-38-7
Catalog Number:
AG019UO1
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
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Product Description
Catalog Number:
AG019UO1
Chemical Name:
3-(3-formylphenoxymethyl)benzonitrile
CAS Number:
928708-38-7
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
MDL Number:
MFCD08753669
IUPAC Name:
3-[(3-formylphenoxy)methyl]benzonitrile
InChI:
InChI=1S/C15H11NO2/c16-9-12-3-1-5-14(7-12)11-18-15-6-2-4-13(8-15)10-17/h1-8,10H,11H2
InChI Key:
YZLHXAJTYDJDPP-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCc1cccc(c1)C#N
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties