morpholin-4-ium hexafluorophosphate

C4H10F6NOP — CID 2775714

IUPACmorpholin-4-ium hexafluorophosphate
SMILESC1COCC[NH2+]1.F[P-](F)(F)(F)(F)F
InChIInChI=1S/C4H9NO.F6P/c1-3-6-4-2-5-1;1-7(2,3,4,5)6/h5H,1-4H2;/q;-1/p+1
InChIKeyLFZWZHAPRWKCRJ-UHFFFAOYSA-O
MW233.09 g/mol
LogP1.96
Rot. Bonds

About morpholin-4-ium hexafluorophosphate

morpholin-4-ium hexafluorophosphate (PubChem CID 2775714) has the molecular formula C4H10F6NOP and a molecular weight of 233.09 g/mol. Its IUPAC name is morpholin-4-ium hexafluorophosphate.

Molecular Properties

Compound Namemorpholin-4-ium hexafluorophosphate
PubChem CID2775714
Molecular FormulaC4H10F6NOP
Molecular Weight233.09 g/mol
Exact Mass233.04
IUPAC Namemorpholin-4-ium hexafluorophosphate
SMILESC1COCC[NH2+]1.F[P-](F)(F)(F)(F)F
InChIInChI=1S/C4H9NO.F6P/c1-3-6-4-2-5-1;1-7(2,3,4,5)6/h5H,1-4H2;/q;-1/p+1
InChIKeyLFZWZHAPRWKCRJ-UHFFFAOYSA-O
XLogP1.96
TPSA25.84 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.09
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-ium hexafluorophosphate?
The IUPAC name of morpholin-4-ium hexafluorophosphate (CID 2775714) is morpholin-4-ium hexafluorophosphate.
What is the SMILES notation for morpholin-4-ium hexafluorophosphate?
The canonical SMILES for morpholin-4-ium hexafluorophosphate is C1COCC[NH2+]1.F[P-](F)(F)(F)(F)F.
What is the InChIKey of morpholin-4-ium hexafluorophosphate?
The InChIKey is LFZWZHAPRWKCRJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H9NO.F6P/c1-3-6-4-2-5-1;1-7(2,3,4,5)6/h5H,1-4H2;/q;-1/p+1.
What are the key properties of morpholin-4-ium hexafluorophosphate?
morpholin-4-ium hexafluorophosphate has a molecular weight of 233.09 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-ium hexafluorophosphate is sourced from PubChem (CID 2775714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).