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1016737-75-9,MFCD09928598
Catalog No.:AA01A8IA
1016737-75-9 | 2-[4-(chlorosulfonyl)-2-fluorophenoxy]acetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$389.00   $272.00
- +
500mg
95.0%
3 weeks  
$700.00   $490.00
- +
1g
95.0%
3 weeks  
$886.00   $620.00
- +
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Technical Information
Catalog Number:
AA01A8IA
Chemical Name:
2-[4-(chlorosulfonyl)-2-fluorophenoxy]acetic acid
CAS Number:
1016737-75-9
Molecular Formula:
C8H6ClFO5S
Molecular Weight:
268.6466
MDL Number:
MFCD09928598
IUPAC Name:
2-(4-chlorosulfonyl-2-fluorophenoxy)acetic acid
InChI:
InChI=1S/C8H6ClFO5S/c9-16(13,14)5-1-2-7(6(10)3-5)15-4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
HYCOQXUHGCEQKB-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1F)S(=O)(=O)Cl
Properties
Computed Properties
 
Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.961g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.639g/mol
Monoisotopic Mass:
267.961g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
2-[4-(chlorosulfonyl)-2-fluorophenoxy]acetic acid 
1016737-75-9 
AC1Q764R 
AKOS000168722 
ZINC100610409 
MCULE-6444823843 
NE17349 
EN300-61874 
(4-Chlorosulfonyl-2-fluoro-phenoxy)-acetic acid 
Literature
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