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898767-84-5

898767-84-5 | 5-(4-IODOPHENYL)-5-OXOVALERONITRILE

CAS No: 898767-84-5 Catalog No: AG00GY1P MDL No:

Product Description

Catalog Number:
AG00GY1P
Chemical Name:
5-(4-IODOPHENYL)-5-OXOVALERONITRILE
CAS Number:
898767-84-5
IUPAC Name:
5-(4-iodophenyl)-5-oxopentanenitrile
InChI:
InChI=1S/C11H10INO/c12-10-6-4-9(5-7-10)11(14)3-1-2-8-13/h4-7H,1-3H2
InChI Key:
KFVPIQLLEFXYMO-UHFFFAOYSA-N

Properties

Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.981g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.111g/mol
Monoisotopic Mass:
298.981g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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