lithium;hydride;iron;methane;phosphoric acid

CH11FeLiO8P2 — CID 175394631

IUPAClithium;hydride;iron;methane;phosphoric acid
SMILESC.O=P(O)(O)O.O=P(O)(O)O.[Fe].[H-].[Li+]
InChIInChI=1S/CH4.Fe.Li.2H3O4P.H/c;;;2*1-5(2,3)4;/h1H4;;;2*(H3,1,2,3,4);/q;;+1;;;-1
InChIKeyATZPKZMNZHJMNE-UHFFFAOYSA-N
MW275.82 g/mol
LogP-4.11
Rot. Bonds

About lithium;hydride;iron;methane;phosphoric acid

lithium;hydride;iron;methane;phosphoric acid (PubChem CID 175394631) has the molecular formula CH11FeLiO8P2 and a molecular weight of 275.82 g/mol. Its IUPAC name is lithium;hydride;iron;methane;phosphoric acid.

Molecular Properties

Compound Namelithium;hydride;iron;methane;phosphoric acid
PubChem CID175394631
Molecular FormulaCH11FeLiO8P2
Molecular Weight275.82 g/mol
Exact Mass275.94
IUPAC Namelithium;hydride;iron;methane;phosphoric acid
SMILESC.O=P(O)(O)O.O=P(O)(O)O.[Fe].[H-].[Li+]
InChIInChI=1S/CH4.Fe.Li.2H3O4P.H/c;;;2*1-5(2,3)4;/h1H4;;;2*(H3,1,2,3,4);/q;;+1;;;-1
InChIKeyATZPKZMNZHJMNE-UHFFFAOYSA-N
XLogP-4.11
TPSA155.52 Ų
H-Bond Donors6
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.82
LogP ≤ 5-4.11
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium;hydride;iron;methane;phosphoric acid?
The IUPAC name of lithium;hydride;iron;methane;phosphoric acid (CID 175394631) is lithium;hydride;iron;methane;phosphoric acid.
What is the SMILES notation for lithium;hydride;iron;methane;phosphoric acid?
The canonical SMILES for lithium;hydride;iron;methane;phosphoric acid is C.O=P(O)(O)O.O=P(O)(O)O.[Fe].[H-].[Li+].
What is the InChIKey of lithium;hydride;iron;methane;phosphoric acid?
The InChIKey is ATZPKZMNZHJMNE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.Fe.Li.2H3O4P.H/c;;;2*1-5(2,3)4;/h1H4;;;2*(H3,1,2,3,4);/q;;+1;;;-1.
What are the key properties of lithium;hydride;iron;methane;phosphoric acid?
lithium;hydride;iron;methane;phosphoric acid has a molecular weight of 275.82 g/mol, XLogP of -4.11, 0 rotatable bonds, 6 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;iron;methane;phosphoric acid is sourced from PubChem (CID 175394631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).