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Creatine Phosphate, Dipotassium Salt

CAT: 0024-sc-221442ASize: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-221442ASize:250 mg
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CAS Number
18838-38-5

Chemical Information

Glycine, N-[imino(phosphonoamino)methyl]-N-methyl-, potassium salt (1:2)
CAS Number18838-38-5
PubChem CID87822
IUPAC Namedipotassium;2-[methyl-(N'-phosphonatocarbamimidoyl)amino]acetic acid
Molecular FormulaC4H8K2N3O5P
Molecular Weight287.29
Topological Polar Surface Area142
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity259
SMILES
CN(CC(=O)O)C(=NP(=O)([O-])[O-])N.[K+].[K+]
InChI
InChI=1S/C4H10N3O5P.2K/c1-7(2-3(8)9)4(5)6-13(10,11)12;;/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12);;/q;2*+1/p-2
InChIKey
SQOKPBMWFCQTDM-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Glycine, N-[imino(phosphonoamino)methyl]-N-methyl-, potassium salt (1:2)
CAS: 18838-38-5
CID: 87822
Formula: C4H8K2N3O5P
MW: 287.29
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight287.29
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass286.94757033
Monoisotopic Mass286.94757033
Topological Polar Surface Area142 Ų
Heavy Atom Count15
Formal Charge0
Complexity259
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes