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32852-95-2

32852-95-2 | 2-(3-phenoxyphenyl)propanenitrile

CAS No: 32852-95-2 Catalog No: AG00382V MDL No:

Product Description

Catalog Number:
AG00382V
Chemical Name:
2-(3-phenoxyphenyl)propanenitrile
CAS Number:
32852-95-2
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
2-(3-phenoxyphenyl)propanenitrile
InChI:
InChI=1S/C15H13NO/c1-12(11-16)13-6-5-9-15(10-13)17-14-7-3-2-4-8-14/h2-10,12H,1H3
InChI Key:
JSCONFOVXYGOST-UHFFFAOYSA-N
SMILES:
N#CC(c1cccc(c1)Oc1ccccc1)C
EC Number:
251-260-9

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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