Home Other Building Blocks 2,4-Bis(trifluoromethyl)toluene

2,4-Bis(trifluoromethyl)toluene

CAS No.:
136664-96-5
Catalog Number:
AG00127E
Molecular Formula:
C9H6F6
Molecular Weight:
228.1344
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$81
- +
1g
97%
1 week
United States
$123
- +
5g
95%
1 week
United States
$296
- +
Product Description
Catalog Number:
AG00127E
Chemical Name:
2,4-Bis(trifluoromethyl)toluene
CAS Number:
136664-96-5
Molecular Formula:
C9H6F6
Molecular Weight:
228.1344
MDL Number:
MFCD00792411
IUPAC Name:
1-methyl-2,4-bis(trifluoromethyl)benzene
InChI:
InChI=1S/C9H6F6/c1-5-2-3-6(8(10,11)12)4-7(5)9(13,14)15/h2-4H,1H3
InChI Key:
ZBIUGZLUAUOIRQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.037g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.137g/mol
Monoisotopic Mass:
228.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties