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186517-45-3,MFCD01631344
Catalog No.:AA003J40
186517-45-3 | 3-CHLORO-2-FLUORO-6-(TRIFLUOROMETHYL)BENZOYL CHLORIDE
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100mg
1 week  
$161.00   $113.00
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1g
1 week  
$192.00   $134.00
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Technical Information
Catalog Number:
AA003J40
Chemical Name:
3-CHLORO-2-FLUORO-6-(TRIFLUOROMETHYL)BENZOYL CHLORIDE
CAS Number:
186517-45-3
Molecular Formula:
C8H2Cl2F4O
Molecular Weight:
261.0005
MDL Number:
MFCD01631344
IUPAC Name:
3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl chloride
InChI:
InChI=1S/C8H2Cl2F4O/c9-4-2-1-3(8(12,13)14)5(6(4)11)7(10)15/h1-2H
InChI Key:
QRJJXSXDJDIRPI-UHFFFAOYSA-N
SMILES:
ClC(=O)c1c(F)c(Cl)ccc1C(F)(F)F
Properties
Computed Properties
 
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.942g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.997g/mol
Monoisotopic Mass:
259.942g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

Synonyms
 
3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl chloride 
186517-45-3 
CTK4D9267 
DTXSID00378711 
JRD-1023 
ZINC2574958 
ZX-AP007043 
PC0153 
SBB102373 
AKOS015955996 
JS-4170 
261763-04-6 
MFCD01631344 
ACM186517453 
CC-14654 
DB-044609 
RT-008656 
FT-0615334 
A813052 
C-16286 
3-chloro-2-fluoro-6-trifluoromethyl benzoyl chloride 
3-Chloro-2-fluoro-6-trifluoromethyl-benzoyl chloride 
I14-61171 
3-chloro-2-fluoro-6-(trifluoromethyl)benzoylchloride 
3-chloranyl-2-fluoranyl-6-(trifluoromethyl)benzoyl chloride 
3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl chloride 97% 
benzoyl chloride, 3-chloro-2-fluoro-6-(trifluoromethyl)- 
3 - Chloro - 2 - fluoro - 6 - trifluoromethyl - benzoyl chloride 
ZINC02574958 
CID2773784 
Benzoyl chloride,2-chloro-3-fluoro-6-(trifluoromethyl)- 
QRJJXSXDJDIRPI-UHFFFAOYSA-N 
AC1MCNGE 
ACMC-1C02F 
SCHEMBL927178 
3-chloro-2-fluoro-6-trifluoromethylbenzoyl chloride 
Literature
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