Home Aldehydes 3-Bromo-2-(trifluoromethyl)benzaldehyde

3-Bromo-2-(trifluoromethyl)benzaldehyde

CAS No.:
1289057-68-6
Catalog Number:
AG000YHR
Molecular Formula:
C8H4BrF3O
Molecular Weight:
253.0160
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$587
- +
1g
97%
1 week
United States
$1270
- +
5g
97%
1 week
United States
$3734
- +
Product Description
Catalog Number:
AG000YHR
Chemical Name:
3-Bromo-2-(trifluoromethyl)benzaldehyde
CAS Number:
1289057-68-6
Molecular Formula:
C8H4BrF3O
Molecular Weight:
253.0160
MDL Number:
MFCD22566297
IUPAC Name:
3-bromo-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H4BrF3O/c9-6-3-1-2-5(4-13)7(6)8(10,11)12/h1-4H
InChI Key:
GNJZENBMBWRNAY-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1C(F)(F)F)Br
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.94g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.018g/mol
Monoisotopic Mass:
251.94g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties