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101513-78-4,MFCD04039245
Catalog No.:AA0004MC
101513-78-4 | 3-Chloro-2,4,5-trifluorobenzoyl chloride
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$43.00   $30.00
- +
5g
95%
in stock  
$115.00   $80.00
- +
25g
95%
in stock  
$426.00   $298.00
- +
  • Technical Information
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0004MC
Chemical Name:
3-Chloro-2,4,5-trifluorobenzoyl chloride
CAS Number:
101513-78-4
Molecular Formula:
C7HCl2F3O
Molecular Weight:
228.9834
MDL Number:
MFCD04039245
IUPAC Name:
3-chloro-2,4,5-trifluorobenzoyl chloride
InChI:
InChI=1S/C7HCl2F3O/c8-4-5(11)2(7(9)13)1-3(10)6(4)12/h1H
InChI Key:
IEDMMCZBIKXEJP-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(F)c(c(c1F)Cl)F
Properties
Computed Properties
 
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.936g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.979g/mol
Monoisotopic Mass:
227.936g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Synonyms
 
3-chloro-2,4,5-trifluorobenzoyl chloride 
101513-78-4 
ZX-AP004477 
MFCD04039245 
PC1853 
SBB097369 
AKOS025310226 
CM12603 
FCH1321002 
3-Chloro-2,4,5-trifluorobenzoylchloride 
AK184034 
PS-10685 
Benzoyl chloride,3-chloro-2,4,5-trifluoro- 
SC-65576 
2,4,5-trifluoro-3-chlorobenzoyl chloride 
Benzoyl chloride, 3-chloro-2,4,5-trifluoro- 
CID2782245 
3-chloro-2,4,5-trifluoro-benzoyl Chloride 
ACMC-20m4kb 
AC1MD1VN 
SCHEMBL8160121 
CTK3J9860 
DTXSID70382002 
IEDMMCZBIKXEJP-UHFFFAOYSA-N 
ZINC2525760 
Literature
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