Home Carboxys 2-(tert-Butoxycarbonyl)-5-thia-2-azaspiro[3.4]octane-8-carboxylic acid 5,5-dioxide

2-(tert-Butoxycarbonyl)-5-thia-2-azaspiro[3.4]octane-8-carboxylic acid 5,5-dioxide

CAS No.:
1340481-81-3
Catalog Number:
AG009JQ0
Molecular Formula:
C12H19NO6S
Molecular Weight:
305.3474
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Product Description
Catalog Number:
AG009JQ0
Chemical Name:
2-(tert-Butoxycarbonyl)-5-thia-2-azaspiro[3.4]octane-8-carboxylic acid 5,5-dioxide
CAS Number:
1340481-81-3
Molecular Formula:
C12H19NO6S
Molecular Weight:
305.3474
MDL Number:
MFCD22199158
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonyl]-5,5-dioxo-5λ6-thia-2-azaspiro[3.4]octane-8-carboxylic acid
InChI:
InChI=1S/C12H19NO6S/c1-11(2,3)19-10(16)13-6-12(7-13)8(9(14)15)4-5-20(12,17)18/h8H,4-7H2,1-3H3,(H,14,15)
InChI Key:
DCZLIUMJKVXWOR-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCS(=O)(=O)C21CN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
535  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.093g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.345g/mol
Monoisotopic Mass:
305.093g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties