Home Aldehydes 2,5-Bis(trifluoromethyl)benzaldehyde

2,5-Bis(trifluoromethyl)benzaldehyde

CAS No.:
395-64-2
Catalog Number:
AG00BXMG
Molecular Formula:
C9H4F6O
Molecular Weight:
242.1179
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$29
- +
25g
97%
In Stock USA
United States
$104
- +
100g
97%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG00BXMG
Chemical Name:
2,5-Bis(trifluoromethyl)benzaldehyde
CAS Number:
395-64-2
Molecular Formula:
C9H4F6O
Molecular Weight:
242.1179
MDL Number:
MFCD00674087
IUPAC Name:
2,5-bis(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C9H4F6O/c10-8(11,12)6-1-2-7(9(13,14)15)5(3-6)4-16/h1-4H
InChI Key:
PICGJIQKPLBIES-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1C(F)(F)F)C(F)(F)F
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.017g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.12g/mol
Monoisotopic Mass:
242.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties