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88193-64-0 | 1H-Furo[3,4-d]imidazole-4-sulfonic acid, hexahydro-2-oxo-
CAS No: 88193-64-0 Catalog No: AG004C5T MDL No:
Product Description
Catalog Number:
AG004C5T
Chemical Name:
1H-Furo[3,4-d]imidazole-4-sulfonic acid, hexahydro-2-oxo-
CAS Number:
88193-64-0
Molecular Formula:
C5H8N2O5S
Molecular Weight:
208.1924
IUPAC Name:
2-oxo-1,3,3a,4,6,6a-hexahydrofuro[3,4-d]imidazole-4-sulfonic acid
InChI:
InChI=1S/C5H8N2O5S/c8-5-6-2-1-12-4(3(2)7-5)13(9,10)11/h2-4H,1H2,(H2,6,7,8)(H,9,10,11)
InChI Key:
FQXXPZONLTUCKY-UHFFFAOYSA-N
SMILES:
O=C1NC2C(N1)C(OC2)S(=O)(=O)O
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
208.188g/mol
Monoisotopic Mass:
208.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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