CID 172816736

H4KNO3P — CID 172816736

IUPAC—
SMILESO=[N+]([O-])O.P.[K]
InChIInChI=1S/K.HNO3.H3P/c;2-1(3)4;/h;(H,2,3,4);1H3
InChIKeyIXOREHVFCMKTAP-UHFFFAOYSA-N
MW136.11 g/mol
LogP-0.67
Rot. Bonds

About CID 172816736

CID 172816736 (PubChem CID 172816736) has the molecular formula H4KNO3P and a molecular weight of 136.11 g/mol.

Molecular Properties

Compound NameCID 172816736
PubChem CID172816736
Molecular FormulaH4KNO3P
Molecular Weight136.11 g/mol
Exact Mass135.96
IUPAC Name—
SMILESO=[N+]([O-])O.P.[K]
InChIInChI=1S/K.HNO3.H3P/c;2-1(3)4;/h;(H,2,3,4);1H3
InChIKeyIXOREHVFCMKTAP-UHFFFAOYSA-N
XLogP-0.67
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.11
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 172816736?
The IUPAC name of CID 172816736 (CID 172816736) is not available.
What is the SMILES notation for CID 172816736?
The canonical SMILES for CID 172816736 is O=[N+]([O-])O.P.[K].
What is the InChIKey of CID 172816736?
The InChIKey is IXOREHVFCMKTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/K.HNO3.H3P/c;2-1(3)4;/h;(H,2,3,4);1H3.
What are the key properties of CID 172816736?
CID 172816736 has a molecular weight of 136.11 g/mol, XLogP of -0.67, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172816736 is sourced from PubChem (CID 172816736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).