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91158-64-4 | 2-Imidazolidinesulfonic acid
CAS No: 91158-64-4 Catalog No: AG006DW5 MDL No:
Product Description
Catalog Number:
AG006DW5
Chemical Name:
2-Imidazolidinesulfonic acid
CAS Number:
91158-64-4
Molecular Formula:
C3H8N2O3S
Molecular Weight:
152.1722
IUPAC Name:
imidazolidine-2-sulfonic acid
InChI:
InChI=1S/C3H8N2O3S/c6-9(7,8)3-4-1-2-5-3/h3-5H,1-2H2,(H,6,7,8)
InChI Key:
DFRXWRKBGSQEDZ-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)C1NCCN1
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.026g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
152.168g/mol
Monoisotopic Mass:
152.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4
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