Home Sulfos Methyl 4-chloro-3-(chlorosulfonyl)benzoate

Methyl 4-chloro-3-(chlorosulfonyl)benzoate

CAS No.:
1000933-19-6
Catalog Number:
AG00H95L
Molecular Formula:
C8H6Cl2O4S
Molecular Weight:
269.1018
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$350
- +
5g
96%
In Stock USA
United States
$1000
- +
10g
96%
In Stock USA
United States
$1600
- +
Product Description
Catalog Number:
AG00H95L
Chemical Name:
Methyl 4-chloro-3-(chlorosulfonyl)benzoate
CAS Number:
1000933-19-6
Molecular Formula:
C8H6Cl2O4S
Molecular Weight:
269.1018
MDL Number:
MFCD09816501
IUPAC Name:
methyl 4-chloro-3-chlorosulfonylbenzoate
InChI:
InChI=1S/C8H6Cl2O4S/c1-14-8(11)5-2-3-6(9)7(4-5)15(10,12)13/h2-4H,1H3
InChI Key:
SXAYTEZGGGOESJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)S(=O)(=O)Cl)Cl
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.936g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.092g/mol
Monoisotopic Mass:
267.936g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties