Home Sulfos Methyl 5-(chlorosulfonyl)-2-fluorobenzoate

Methyl 5-(chlorosulfonyl)-2-fluorobenzoate

CAS No.:
1094460-86-2
Catalog Number:
AG00HBHX
Molecular Formula:
C8H6ClFO4S
Molecular Weight:
252.6472
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$300
- +
5g
95%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00HBHX
Chemical Name:
Methyl 5-(chlorosulfonyl)-2-fluorobenzoate
CAS Number:
1094460-86-2
Molecular Formula:
C8H6ClFO4S
Molecular Weight:
252.6472
MDL Number:
MFCD11650665
IUPAC Name:
methyl 5-chlorosulfonyl-2-fluorobenzoate
InChI:
InChI=1S/C8H6ClFO4S/c1-14-8(11)6-4-5(15(9,12)13)2-3-7(6)10/h2-4H,1H3
InChI Key:
OIQQZWQRLDURLP-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1F)S(=O)(=O)Cl
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.966g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.64g/mol
Monoisotopic Mass:
251.966g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties