azane;phosphoric acid;phosphorous acid

H24N6O7P2 — CID 173381838

IUPACazane;phosphoric acid;phosphorous acid
SMILESN.N.N.N.N.N.O=P(O)(O)O.OP(O)O
InChIInChI=1S/6H3N.H3O4P.H3O3P/c;;;;;;1-5(2,3)4;1-4(2)3/h6*1H3;(H3,1,2,3,4);1-3H
InChIKeySSMRCNUTZWFUDU-UHFFFAOYSA-N
MW282.18 g/mol
LogP-0.77
Rot. Bonds

About azane;phosphoric acid;phosphorous acid

azane;phosphoric acid;phosphorous acid (PubChem CID 173381838) has the molecular formula H24N6O7P2 and a molecular weight of 282.18 g/mol. Its IUPAC name is azane;phosphoric acid;phosphorous acid.

Molecular Properties

Compound Nameazane;phosphoric acid;phosphorous acid
PubChem CID173381838
Molecular FormulaH24N6O7P2
Molecular Weight282.18 g/mol
Exact Mass282.12
IUPAC Nameazane;phosphoric acid;phosphorous acid
SMILESN.N.N.N.N.N.O=P(O)(O)O.OP(O)O
InChIInChI=1S/6H3N.H3O4P.H3O3P/c;;;;;;1-5(2,3)4;1-4(2)3/h6*1H3;(H3,1,2,3,4);1-3H
InChIKeySSMRCNUTZWFUDU-UHFFFAOYSA-N
XLogP-0.77
TPSA348.45 Ų
H-Bond Donors12
H-Bond Acceptors10
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.18
LogP ≤ 5-0.77
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

azane;phosphoric acid;phosphorous acid
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CID 172998917
CID 172998917
azane;iron;phosphoric acid
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Frequently Asked Questions

What is the IUPAC name of azane;phosphoric acid;phosphorous acid?
The IUPAC name of azane;phosphoric acid;phosphorous acid (CID 173381838) is azane;phosphoric acid;phosphorous acid.
What is the SMILES notation for azane;phosphoric acid;phosphorous acid?
The canonical SMILES for azane;phosphoric acid;phosphorous acid is N.N.N.N.N.N.O=P(O)(O)O.OP(O)O.
What is the InChIKey of azane;phosphoric acid;phosphorous acid?
The InChIKey is SSMRCNUTZWFUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/6H3N.H3O4P.H3O3P/c;;;;;;1-5(2,3)4;1-4(2)3/h6*1H3;(H3,1,2,3,4);1-3H.
What are the key properties of azane;phosphoric acid;phosphorous acid?
azane;phosphoric acid;phosphorous acid has a molecular weight of 282.18 g/mol, XLogP of -0.77, 0 rotatable bonds, 12 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for azane;phosphoric acid;phosphorous acid is sourced from PubChem (CID 173381838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).