Home Nitriles 1-(trifluoromethyl)cyclopentane-1-carbonitrile

1-(trifluoromethyl)cyclopentane-1-carbonitrile

CAS No.:
1260902-25-7
Catalog Number:
AG01C8EX
Molecular Formula:
C7H8F3N
Molecular Weight:
163.1403
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Product Description
Catalog Number:
AG01C8EX
Chemical Name:
1-(trifluoromethyl)cyclopentane-1-carbonitrile
CAS Number:
1260902-25-7
Molecular Formula:
C7H8F3N
Molecular Weight:
163.1403
MDL Number:
MFCD15527043
IUPAC Name:
1-(trifluoromethyl)cyclopentane-1-carbonitrile
InChI:
InChI=1S/C7H8F3N/c8-7(9,10)6(5-11)3-1-2-4-6/h1-4H2
InChI Key:
OCJZECXHONKWKL-UHFFFAOYSA-N
SMILES:
N#CC1(CCCC1)C(F)(F)F
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.143g/mol
Monoisotopic Mass:
163.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties