CID 175052778

H4FeNO2P — CID 175052778

IUPAC—
SMILESO=P[O-].[Fe].[NH4+]
InChIInChI=1S/Fe.H3N.HO2P/c;;1-3-2/h;1H3;(H,1,2)
InChIKeyOFQUXMKJFZKTBW-UHFFFAOYSA-N
MW136.86 g/mol
LogP-0.07
Rot. Bonds

About CID 175052778

CID 175052778 (PubChem CID 175052778) has the molecular formula H4FeNO2P and a molecular weight of 136.86 g/mol.

Molecular Properties

Compound NameCID 175052778
PubChem CID175052778
Molecular FormulaH4FeNO2P
Molecular Weight136.86 g/mol
Exact Mass136.93
IUPAC Name—
SMILESO=P[O-].[Fe].[NH4+]
InChIInChI=1S/Fe.H3N.HO2P/c;;1-3-2/h;1H3;(H,1,2)
InChIKeyOFQUXMKJFZKTBW-UHFFFAOYSA-N
XLogP-0.07
TPSA76.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.86
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
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 CID 175052778?
The IUPAC name of CID 175052778 (CID 175052778) is not available.
What is the SMILES notation for CID 175052778?
The canonical SMILES for CID 175052778 is O=P[O-].[Fe].[NH4+].
What is the InChIKey of CID 175052778?
The InChIKey is OFQUXMKJFZKTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/Fe.H3N.HO2P/c;;1-3-2/h;1H3;(H,1,2).
What are the key properties of CID 175052778?
CID 175052778 has a molecular weight of 136.86 g/mol, XLogP of -0.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175052778 is sourced from PubChem (CID 175052778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).