aminophosphonic acid;ethane-1,2-diol

C2H10NO5P — CID 121316175

IUPACaminophosphonic acid;ethane-1,2-diol
SMILESNP(=O)(O)O.OCCO
InChIInChI=1S/C2H6O2.H4NO3P/c3-1-2-4;1-5(2,3)4/h3-4H,1-2H2;(H4,1,2,3,4)
InChIKeyFJLPVDNTXHUQJV-UHFFFAOYSA-N
MW159.08 g/mol
LogP-1.99
Rot. Bonds1

About aminophosphonic acid;ethane-1,2-diol

aminophosphonic acid;ethane-1,2-diol (PubChem CID 121316175) has the molecular formula C2H10NO5P and a molecular weight of 159.08 g/mol. Its IUPAC name is aminophosphonic acid;ethane-1,2-diol.

Molecular Properties

Compound Nameaminophosphonic acid;ethane-1,2-diol
PubChem CID121316175
Molecular FormulaC2H10NO5P
Molecular Weight159.08 g/mol
Exact Mass159.03
IUPAC Nameaminophosphonic acid;ethane-1,2-diol
SMILESNP(=O)(O)O.OCCO
InChIInChI=1S/C2H6O2.H4NO3P/c3-1-2-4;1-5(2,3)4/h3-4H,1-2H2;(H4,1,2,3,4)
InChIKeyFJLPVDNTXHUQJV-UHFFFAOYSA-N
XLogP-1.99
TPSA124.01 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.08
LogP ≤ 5-1.99
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

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2-aminoethanol;phosphane;phosphoric acid
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CID 162132831
CID 162132831
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tripotassium;tris(ethane-1,2-diol);phosphate
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Frequently Asked Questions

What is the IUPAC name of aminophosphonic acid;ethane-1,2-diol?
The IUPAC name of aminophosphonic acid;ethane-1,2-diol (CID 121316175) is aminophosphonic acid;ethane-1,2-diol.
What is the SMILES notation for aminophosphonic acid;ethane-1,2-diol?
The canonical SMILES for aminophosphonic acid;ethane-1,2-diol is NP(=O)(O)O.OCCO.
What is the InChIKey of aminophosphonic acid;ethane-1,2-diol?
The InChIKey is FJLPVDNTXHUQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O2.H4NO3P/c3-1-2-4;1-5(2,3)4/h3-4H,1-2H2;(H4,1,2,3,4).
What are the key properties of aminophosphonic acid;ethane-1,2-diol?
aminophosphonic acid;ethane-1,2-diol has a molecular weight of 159.08 g/mol, XLogP of -1.99, 1 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for aminophosphonic acid;ethane-1,2-diol is sourced from PubChem (CID 121316175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).