Home Halogens 3,4,5-Trifluorobenzotrifluoride

3,4,5-Trifluorobenzotrifluoride

CAS No.:
80172-04-9
Catalog Number:
AG005CJY
Molecular Formula:
C7H2F6
Molecular Weight:
200.0812
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$143
- +
Product Description
Catalog Number:
AG005CJY
Chemical Name:
3,4,5-Trifluorobenzotrifluoride
CAS Number:
80172-04-9
Molecular Formula:
C7H2F6
Molecular Weight:
200.0812
MDL Number:
MFCD00153280
IUPAC Name:
1,2,3-trifluoro-5-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2F6/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2H
InChI Key:
WIMUDCCCIFLMQO-UHFFFAOYSA-N
SMILES:
Fc1c(F)cc(cc1F)C(F)(F)F
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.006g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.083g/mol
Monoisotopic Mass:
200.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties