Home Nitriles 3-(2,2-difluoroethoxy)propanenitrile

3-(2,2-difluoroethoxy)propanenitrile

CAS No.:
1309602-19-4
Catalog Number:
AG01B1K1
Molecular Formula:
C5H7F2NO
Molecular Weight:
135.1120
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Product Description
Catalog Number:
AG01B1K1
Chemical Name:
3-(2,2-difluoroethoxy)propanenitrile
CAS Number:
1309602-19-4
Molecular Formula:
C5H7F2NO
Molecular Weight:
135.1120
MDL Number:
MFCD19442116
IUPAC Name:
3-(2,2-difluoroethoxy)propanenitrile
InChI:
InChI=1S/C5H7F2NO/c6-5(7)4-9-3-1-2-8/h5H,1,3-4H2
InChI Key:
ILHGGPWCYULXAZ-UHFFFAOYSA-N
SMILES:
N#CCCOCC(F)F
Properties
Complexity:
107  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.05g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.114g/mol
Monoisotopic Mass:
135.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties