Home Nitriles 3,5-difluoro-4-(morpholin-4-yl)benzonitrile

3,5-difluoro-4-(morpholin-4-yl)benzonitrile

CAS No.:
1481179-72-9
Catalog Number:
AG01C1RD
Molecular Formula:
C11H10F2N2O
Molecular Weight:
224.2067
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Product Description
Catalog Number:
AG01C1RD
Chemical Name:
3,5-difluoro-4-(morpholin-4-yl)benzonitrile
CAS Number:
1481179-72-9
Molecular Formula:
C11H10F2N2O
Molecular Weight:
224.2067
MDL Number:
MFCD22742359
IUPAC Name:
3,5-difluoro-4-morpholin-4-ylbenzonitrile
InChI:
InChI=1S/C11H10F2N2O/c12-9-5-8(7-14)6-10(13)11(9)15-1-3-16-4-2-15/h5-6H,1-4H2
InChI Key:
AJUCLIASGYDYQE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(c(c1)F)N1CCOCC1
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.076g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.211g/mol
Monoisotopic Mass:
224.076g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties