Home Sulfos 3-(2-chloroethanesulfonyl)propanoic acid

3-(2-chloroethanesulfonyl)propanoic acid

CAS No.:
3884-76-2
Catalog Number:
AG01EHRX
Molecular Formula:
C5H9ClO4S
Molecular Weight:
200.6406
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EHRX
Chemical Name:
3-(2-chloroethanesulfonyl)propanoic acid
CAS Number:
3884-76-2
Molecular Formula:
C5H9ClO4S
Molecular Weight:
200.6406
MDL Number:
MFCD00181970
IUPAC Name:
3-(2-chloroethylsulfonyl)propanoic acid
InChI:
InChI=1S/C5H9ClO4S/c6-2-4-11(9,10)3-1-5(7)8/h1-4H2,(H,7,8)
InChI Key:
YVVYXBHBVZBALB-UHFFFAOYSA-N
SMILES:
ClCCS(=O)(=O)CCC(=O)O
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.991g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.633g/mol
Monoisotopic Mass:
199.991g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties