dimethylaminophosphanium perchlorate

C2H9ClNO4P — CID 158506862

IUPACdimethylaminophosphanium perchlorate
SMILESCN(C)[PH3+].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C2H8NP.ClHO4/c1-3(2)4;2-1(3,4)5/h4H2,1-2H3;(H,2,3,4,5)
InChIKeyHKOJKRBCYIGKNR-UHFFFAOYSA-N
MW177.52 g/mol
LogP-4.69
Rot. Bonds

About dimethylaminophosphanium perchlorate

dimethylaminophosphanium perchlorate (PubChem CID 158506862) has the molecular formula C2H9ClNO4P and a molecular weight of 177.52 g/mol. Its IUPAC name is dimethylaminophosphanium perchlorate.

Molecular Properties

Compound Namedimethylaminophosphanium perchlorate
PubChem CID158506862
Molecular FormulaC2H9ClNO4P
Molecular Weight177.52 g/mol
Exact Mass177.00
IUPAC Namedimethylaminophosphanium perchlorate
SMILESCN(C)[PH3+].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C2H8NP.ClHO4/c1-3(2)4;2-1(3,4)5/h4H2,1-2H3;(H,2,3,4,5)
InChIKeyHKOJKRBCYIGKNR-UHFFFAOYSA-N
XLogP-4.69
TPSA95.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.52
LogP ≤ 5-4.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethylaminophosphanium perchlorate?
The IUPAC name of dimethylaminophosphanium perchlorate (CID 158506862) is dimethylaminophosphanium perchlorate.
What is the SMILES notation for dimethylaminophosphanium perchlorate?
The canonical SMILES for dimethylaminophosphanium perchlorate is CN(C)[PH3+].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of dimethylaminophosphanium perchlorate?
The InChIKey is HKOJKRBCYIGKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8NP.ClHO4/c1-3(2)4;2-1(3,4)5/h4H2,1-2H3;(H,2,3,4,5).
What are the key properties of dimethylaminophosphanium perchlorate?
dimethylaminophosphanium perchlorate has a molecular weight of 177.52 g/mol, XLogP of -4.69, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylaminophosphanium perchlorate is sourced from PubChem (CID 158506862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).