Home Aldehydes 4-Nitro-2-(trifluoromethyl)benzaldehyde

4-Nitro-2-(trifluoromethyl)benzaldehyde

CAS No.:
50551-17-2
Catalog Number:
AG00E1CT
Molecular Formula:
C8H4F3NO3
Molecular Weight:
219.1175
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95+%
1 week
United States
$73
- +
1g
95%
1 week
United States
$280
- +
5g
95%
1 week
United States
$763
- +
Product Description
Catalog Number:
AG00E1CT
Chemical Name:
4-Nitro-2-(trifluoromethyl)benzaldehyde
CAS Number:
50551-17-2
Molecular Formula:
C8H4F3NO3
Molecular Weight:
219.1175
MDL Number:
MFCD13185769
IUPAC Name:
4-nitro-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H4F3NO3/c9-8(10,11)7-3-6(12(14)15)2-1-5(7)4-13/h1-4H
InChI Key:
CREGKXZIHOMXBJ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.014g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.119g/mol
Monoisotopic Mass:
219.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties