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N-Guanylurea sulfate

CAT: 0063-36862838Size: 5 gDry Ice: NoHazardous: No
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CAT#:0063-36862838Size:5 g
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CAS Number
591-01-5

Chemical Information

Dicyanodiamidine sulfate
CAS Number591-01-5
PubChem CID11555
IUPAC Namebis(diaminomethylideneurea);sulfuric acid
Molecular FormulaC4H14N8O6S
Molecular Weight302.27
Topological Polar Surface Area298
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity184
SMILES
C(=NC(=O)N)(N)N.C(=NC(=O)N)(N)N.OS(=O)(=O)O
InChI
InChI=1S/2C2H6N4O.H2O4S/c2*3-1(4)6-2(5)7;1-5(2,3)4/h2*(H6,3,4,5,6,7);(H2,1,2,3,4)
InChIKey
IATXFPUBPMZBPH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dicyanodiamidine sulfate
CAS: 591-01-5
CID: 11555
Formula: C4H14N8O6S
MW: 302.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight302.27
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass302.07570137
Monoisotopic Mass302.07570137
Topological Polar Surface Area298 Ų
Heavy Atom Count19
Formal Charge0
Complexity184
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes