3-(3-aminopropylamino)propylsulfanylphosphonic acid;pentahydrate
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3-(3-aminopropylamino)propylsulfanylphosphonic acid;pentahydrate
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CAS No:
63717-30-6
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Formula:
C12H44N4O11P2S2
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Chemical Name:
3-(3-aminopropylamino)propylsulfanylphosphonic acid;pentahydrate
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Synonyms:
63717-30-6;Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5);DTXSID80980154;S-2-((3-Aminopropyl)amino)propyl dihydrogen phosphorothioate hydrate (2:2:5);Phosphorothioic acid, S-ester with 2-((3-aminopropyl)amino)propanethiol, hydrate (2:2:5);Propanethiol, 2-((3-aminopropyl)amino)-, dihydrogen phosphate (ester) hydrate (2:2:5);S-{3-[(3-Aminopropyl)amino]propyl} dihydrogen phosphorothioate--water (2/5)
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CAS No:
3-(3-aminopropylamino)propylsulfanylphosphonic acid;pentahydrate Basic Attributes
546.6 g/mol
546.19232457 g/mol
Computed Properties
Molecular Weight:546.6
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:16
Exact Mass:546.19232457
Monoisotopic Mass:546.19232457
Topological Polar Surface Area:247
Heavy Atom Count:31
Complexity:164
Covalently-Bonded Unit Count:7
Compound Is Canonicalized:Yes
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