Home Halogens 3-Chloro-4,5-difluorobenzotrifluoride

3-Chloro-4,5-difluorobenzotrifluoride

CAS No.:
77227-99-7
Catalog Number:
AG00G2DV
Molecular Formula:
C7H2ClF5
Molecular Weight:
216.5358
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$57
- +
5g
97%
In Stock USA
United States
$150
- +
10g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00G2DV
Chemical Name:
3-Chloro-4,5-difluorobenzotrifluoride
CAS Number:
77227-99-7
Molecular Formula:
C7H2ClF5
Molecular Weight:
216.5358
MDL Number:
MFCD00153090
IUPAC Name:
1-chloro-2,3-difluoro-5-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2ClF5/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2H
InChI Key:
RZMVFJHGONCXQR-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1F)Cl)C(F)(F)F
EC Number:
401-930-3
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.977g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.535g/mol
Monoisotopic Mass:
215.977g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties