Home Carboxys 2,2-dioxo-2lambda6-thiaspiro[3.3]heptane-6-carboxylic acid

2,2-dioxo-2lambda6-thiaspiro[3.3]heptane-6-carboxylic acid

CAS No.:
2092286-66-1
Catalog Number:
AG01BVUE
Molecular Formula:
C7H10O4S
Molecular Weight:
190.2169
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Product Description
Catalog Number:
AG01BVUE
Chemical Name:
2,2-dioxo-2lambda6-thiaspiro[3.3]heptane-6-carboxylic acid
CAS Number:
2092286-66-1
Molecular Formula:
C7H10O4S
Molecular Weight:
190.2169
MDL Number:
MFCD30635373
IUPAC Name:
2,2-dioxo-2λ6-thiaspiro[3.3]heptane-6-carboxylic acid
InChI:
InChI=1S/C7H10O4S/c8-6(9)5-1-7(2-5)3-12(10,11)4-7/h5H,1-4H2,(H,8,9)
InChI Key:
AUUBVSVUCMPSKW-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC2(C1)CS(=O)(=O)C2
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.213g/mol
Monoisotopic Mass:
190.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties