1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium

C2H14NO6P2SnTc+ — CID 173448755

IUPAC1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium
SMILESCC(N)P(=O)(O)O.O=[P+](O)O.[SnH4].[Tc]
InChIInChI=1S/C2H8NO3P.HO3P.Sn.Tc.4H/c1-2(3)7(4,5)6;1-4(2)3;;;;;;/h2H,3H2,1H3,(H2,4,5,6);(H-,1,2,3);;;;;;/p+1
InChIKeyIOKLXOPCIABHLA-UHFFFAOYSA-O
MW426.79 g/mol
LogP-2.36
Rot. Bonds1

About 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium

1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium (PubChem CID 173448755) has the molecular formula C2H14NO6P2SnTc+ and a molecular weight of 426.79 g/mol. Its IUPAC name is 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium.

Molecular Properties

Compound Name1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium
PubChem CID173448755
Molecular FormulaC2H14NO6P2SnTc+
Molecular Weight426.79 g/mol
Exact Mass426.84
IUPAC Name1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium
SMILESCC(N)P(=O)(O)O.O=[P+](O)O.[SnH4].[Tc]
InChIInChI=1S/C2H8NO3P.HO3P.Sn.Tc.4H/c1-2(3)7(4,5)6;1-4(2)3;;;;;;/h2H,3H2,1H3,(H2,4,5,6);(H-,1,2,3);;;;;;/p+1
InChIKeyIOKLXOPCIABHLA-UHFFFAOYSA-O
XLogP-2.36
TPSA141.08 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.79
LogP ≤ 5-2.36
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

[(1R)-1-aminoethyl]phosphonic acid;hydrochloride
CID 88516256
1,2-dihydroxyethylphosphonic acid;dihydroxy(oxo)phosphanium
CID 87424977
dihydroxy(oxo)phosphanium;phosphoric acid;zirconium
CID 173299921
[(2R)-2-aminopropyl]phosphonic acid
CID 92524852
bis(dihydroxy(oxo)phosphanium);technetium-99
CID 6328361
dihydroxy(oxo)phosphanium;oxophosphanium;phosphoric acid
CID 162249587
[(2R)-2-amino-3-methylbutyl]phosphonic acid
CID 102215252
[(4R)-4-amino-3-oxopentan-2-yl]phosphonic acid
CID 14541313
amino-hydroxy-oxophosphanium;aminophosphonic acid
CID 161400916
disodium;bis(dihydrogen phosphate);dihydroxy(oxo)phosphanium
CID 172821618
3-aminopropylphosphonic acid;dihydroxy(oxo)phosphanium
CID 88769819
dihydroxy(oxo)phosphanium;(1-hydroxy-1-phosphonoethyl)phosphonic acid
CID 88726549

Frequently Asked Questions

What is the IUPAC name of 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium?
The IUPAC name of 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium (CID 173448755) is 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium.
What is the SMILES notation for 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium?
The canonical SMILES for 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium is CC(N)P(=O)(O)O.O=[P+](O)O.[SnH4].[Tc].
What is the InChIKey of 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium?
The InChIKey is IOKLXOPCIABHLA-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H8NO3P.HO3P.Sn.Tc.4H/c1-2(3)7(4,5)6;1-4(2)3;;;;;;/h2H,3H2,1H3,(H2,4,5,6);(H-,1,2,3);;;;;;/p+1.
What are the key properties of 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium?
1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium has a molecular weight of 426.79 g/mol, XLogP of -2.36, 1 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminoethylphosphonic acid;dihydroxy(oxo)phosphanium;stannane;technetium is sourced from PubChem (CID 173448755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).