CID 173167224

H11AlO13P3 — CID 173167224

IUPAC—
SMILESO.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.[Al]
InChIInChI=1S/Al.3H3O4P.H2O/c;3*1-5(2,3)4;/h;3*(H3,1,2,3,4);1H2
InChIKeyQELGQOFWDPQMQH-UHFFFAOYSA-N
MW338.98 g/mol
LogP-3.99
Rot. Bonds

About CID 173167224

CID 173167224 (PubChem CID 173167224) has the molecular formula H11AlO13P3 and a molecular weight of 338.98 g/mol.

Molecular Properties

Compound NameCID 173167224
PubChem CID173167224
Molecular FormulaH11AlO13P3
Molecular Weight338.98 g/mol
Exact Mass338.92
IUPAC Name—
SMILESO.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.[Al]
InChIInChI=1S/Al.3H3O4P.H2O/c;3*1-5(2,3)4;/h;3*(H3,1,2,3,4);1H2
InChIKeyQELGQOFWDPQMQH-UHFFFAOYSA-N
XLogP-3.99
TPSA264.78 Ų
H-Bond Donors9
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.98
LogP ≤ 5-3.99
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

phosphoric acid;hydrate
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phosphoric acid;octahydrate
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boric acid;phosphoric acid;hydrate
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calcium;phosphoric acid;hydrate
CID 170923527
phosphoric acid;titanium;hydrate
CID 173357749
copper;phosphoric acid;hydrate
CID 516939
neodymium;phosphoric acid;hydrate
CID 156593884
phosphane;phosphoric acid;hydrate
CID 157469515
phosphoric acid;zinc;octahydrate
CID 173057080
azane;phosphoric acid;hydrate
CID 173222009

Frequently Asked Questions

What is the IUPAC name of CID 173167224?
The IUPAC name of CID 173167224 (CID 173167224) is not available.
What is the SMILES notation for CID 173167224?
The canonical SMILES for CID 173167224 is O.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.[Al].
What is the InChIKey of CID 173167224?
The InChIKey is QELGQOFWDPQMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.3H3O4P.H2O/c;3*1-5(2,3)4;/h;3*(H3,1,2,3,4);1H2.
What are the key properties of CID 173167224?
CID 173167224 has a molecular weight of 338.98 g/mol, XLogP of -3.99, 0 rotatable bonds, 9 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173167224 is sourced from PubChem (CID 173167224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).