Home Nitriles 1-(Trifluoromethyl)cyclopropane-1-carbonitrile

1-(Trifluoromethyl)cyclopropane-1-carbonitrile

CAS No.:
96110-56-4
Catalog Number:
AG019RF4
Molecular Formula:
C5H4F3N
Molecular Weight:
135.0872
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$552
- +
500mg
1 week
United States
$774
- +
Product Description
Catalog Number:
AG019RF4
Chemical Name:
1-(Trifluoromethyl)cyclopropane-1-carbonitrile
CAS Number:
96110-56-4
Molecular Formula:
C5H4F3N
Molecular Weight:
135.0872
MDL Number:
MFCD16990764
IUPAC Name:
1-(trifluoromethyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C5H4F3N/c6-5(7,8)4(3-9)1-2-4/h1-2H2
InChI Key:
VZQMRRQNVCBXHM-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)C(F)(F)F
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.03g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.089g/mol
Monoisotopic Mass:
135.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties