sales@angenesci.com
Login | Register
logo
Structures Search
Home Aldehydes 3-Fluoro-4-(trifluoromethyl)benzaldehyde

3-Fluoro-4-(trifluoromethyl)benzaldehyde

CAS No.:
204339-72-0
Catalog Number:
AG0029FY
Molecular Formula:
C8H4F4O
Molecular Weight:
192.1104
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$15
- +
5g
98%
In Stock USA
United States
$48
- +
25g
98%
In Stock USA
United States
$207
- +
100g
98%
In Stock USA
United States
$598
- +
Product Description
Catalog Number:
AG0029FY
Chemical Name:
3-Fluoro-4-(trifluoromethyl)benzaldehyde
CAS Number:
204339-72-0
Molecular Formula:
C8H4F4O
Molecular Weight:
192.1104
MDL Number:
MFCD00236275
IUPAC Name:
3-fluoro-4-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H4F4O/c9-7-3-5(4-13)1-2-6(7)8(10,11)12/h1-4H
InChI Key:
ZVIQXFUBNNGOJY-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)C(F)(F)F
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.113g/mol
Monoisotopic Mass:
192.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Design, synthesis, and structure-activity relationship exploration of 1-substituted 4-aroyl-3-hydroxy-5-phenyl-1H-pyrrol-2(5H)-one analogues as inhibitors of the annexin A2-S100A10 protein interaction. Journal of medicinal chemistry 20110414
Properties