Home Nitriles 5,5-Difluorohexanenitrile

5,5-Difluorohexanenitrile

CAS No.:
2368-89-0
Catalog Number:
AG01FFIP
Molecular Formula:
C6H9F2N
Molecular Weight:
133.1392
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$364
- +
5g
95%
1 week
United States
$1323
- +
Product Description
Catalog Number:
AG01FFIP
Chemical Name:
5,5-Difluorohexanenitrile
CAS Number:
2368-89-0
Molecular Formula:
C6H9F2N
Molecular Weight:
133.1392
MDL Number:
MFCD19300798
IUPAC Name:
5,5-difluorohexanenitrile
InChI:
InChI=1S/C6H9F2N/c1-6(7,8)4-2-3-5-9/h2-4H2,1H3
InChI Key:
LWXATOWVEUZBGA-UHFFFAOYSA-N
SMILES:
N#CCCCC(F)(F)C
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.07g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.142g/mol
Monoisotopic Mass:
133.07g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties