Home Fluorides 658-91-3
658-91-3,MFCD00041512
Catalog No.:AA003I7P
658-91-3 | 3-(Trifluoromethoxy)benzamide
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  • Technical Information
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Technical Information
Catalog Number:
AA003I7P
Chemical Name:
3-(Trifluoromethoxy)benzamide
CAS Number:
658-91-3
Molecular Formula:
C8H6F3NO2
Molecular Weight:
205.1339
MDL Number:
MFCD00041512
IUPAC Name:
3-(trifluoromethoxy)benzamide
InChI:
InChI=1S/C8H6F3NO2/c9-8(10,11)14-6-3-1-2-5(4-6)7(12)13/h1-4H,(H2,12,13)
InChI Key:
RRANUIMYSXUNCN-UHFFFAOYSA-N
SMILES:
NC(=O)c1cccc(c1)OC(F)(F)F
Properties
Computed Properties
 
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.035g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.136g/mol
Monoisotopic Mass:
205.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Synonyms
 
3-(Trifluoromethoxy)benzamide 
658-91-3 
CTK5C3227 
DTXSID60334878 
3 - Trifluoromethoxy - benzamide 
benzamide, 3-(trifluoromethoxy)- 
RRANUIMYSXUNCN-UHFFFAOYSA-N 
ZINC156313 
JRD-1227 
7553AE 
SBB037941 
AKOS005207125 
MFCD00041512 
JS-4218 
MCULE-4920941771 
VZ26127 
ST085932 
ZB006289 
DB-021752 
TR-022359 
FT-0083246 
FT-0613900 
A835265 
AC1LAWM2 
I01-14880 
C8H6F3NO2 
CID522189 
ZINC00156313 
3-Trifluoromethoxy-benzamide 
SCHEMBL711132 
3-(trifluoromethyloxy)benzamide 
ACMC-1B717 
CHEMBL457051 
Benzamide,3-(trifluoromethoxy)- 
Literature

Title: Antibacterial alkoxybenzamide inhibitors of the essential bacterial cell division protein FtsZ.

Journal: Bioorganic & medicinal chemistry letters 20090115

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