Guanidinoethyl sulfonate

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Catalog Number
ACM543180
Product Name
Guanidinoethyl sulfonate
Structure
Structure
CAS
543-18-0
Category
Heterocyclic Organic Compound
Synonyms
N-Amidinotaurine
IUPAC Name
2-(Diaminomethylideneamino)ethanesulfonic acid
Molecular Weight
167.19
Molecular Formula
C3H9N3O3S
Canonical SMILES
C(CS(=O)(=O)O)N=C(N)N
InChI
InChI=1S/C3H9N3O3S/c4-3(5)6-1-2-10(7,8)9/h1-2H2,(H4,4,5,6)(H,7,8,9)
InChI Key
JKLRIMRKZBSSED-UHFFFAOYSA-N
Melting Point
263-265 °C
Density
1.73±0.1 g/cm³
Appearance
White to off-white solid
Storage
Refrigerator
Complexity
210
Exact Mass
167.03646233
Monoisotopic Mass
167.03646233
pKa
1.31±0.50(Predicted)
Refractive Index
1.618
Topological Polar Surface Area
127 Ų
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