Home Carboxys 2-methyl-1,1-dioxo-1,2-thiazolidine-5-carboxylic acid

2-methyl-1,1-dioxo-1,2-thiazolidine-5-carboxylic acid

CAS No.:
1909319-87-4
Catalog Number:
AG01C3GP
Molecular Formula:
C5H9NO4S
Molecular Weight:
179.1943
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Product Description
Catalog Number:
AG01C3GP
Chemical Name:
2-methyl-1,1-dioxo-1,2-thiazolidine-5-carboxylic acid
CAS Number:
1909319-87-4
Molecular Formula:
C5H9NO4S
Molecular Weight:
179.1943
MDL Number:
MFCD29762807
IUPAC Name:
2-methyl-1,1-dioxo-1,2-thiazolidine-5-carboxylic acid
InChI:
InChI=1S/C5H9NO4S/c1-6-3-2-4(5(7)8)11(6,9)10/h4H,2-3H2,1H3,(H,7,8)
InChI Key:
FHUFIMQTQRKPRH-UHFFFAOYSA-N
SMILES:
CN1CCC(S1(=O)=O)C(=O)O
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.025g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.19g/mol
Monoisotopic Mass:
179.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties