Home Carboxys Ethyl 1,1-dioxo-isothiazolidine-3-carboxylate

Ethyl 1,1-dioxo-isothiazolidine-3-carboxylate

CAS No.:
1253789-57-9
Catalog Number:
AG000NL6
Molecular Formula:
C6H11NO4S
Molecular Weight:
193.2208
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$278
- +
1g
97%
1 week
United States
$639
- +
Product Description
Catalog Number:
AG000NL6
Chemical Name:
Ethyl 1,1-dioxo-isothiazolidine-3-carboxylate
CAS Number:
1253789-57-9
Molecular Formula:
C6H11NO4S
Molecular Weight:
193.2208
MDL Number:
MFCD09878821
IUPAC Name:
ethyl 1,1-dioxo-1,2-thiazolidine-3-carboxylate
InChI:
InChI=1S/C6H11NO4S/c1-2-11-6(8)5-3-4-12(9,10)7-5/h5,7H,2-4H2,1H3
InChI Key:
DOQNCFXSMXIUGB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCS(=O)(=O)N1
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.041g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.217g/mol
Monoisotopic Mass:
193.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties