aminooxymethyl-methoxy-sulfanylidenephosphanium

C2H7NO2PS+ — CID 163571316

IUPACaminooxymethyl-methoxy-sulfanylidenephosphanium
SMILESCO[P+](=S)CON
InChIInChI=1S/C2H7NO2PS/c1-4-6(7)2-5-3/h2-3H2,1H3/q+1
InChIKeyMSNCSTJLQQNWJL-UHFFFAOYSA-N
MW140.12 g/mol
LogP0.34
Rot. Bonds3

About aminooxymethyl-methoxy-sulfanylidenephosphanium

aminooxymethyl-methoxy-sulfanylidenephosphanium (PubChem CID 163571316) has the molecular formula C2H7NO2PS+ and a molecular weight of 140.12 g/mol. Its IUPAC name is aminooxymethyl-methoxy-sulfanylidenephosphanium.

Molecular Properties

Compound Nameaminooxymethyl-methoxy-sulfanylidenephosphanium
PubChem CID163571316
Molecular FormulaC2H7NO2PS+
Molecular Weight140.12 g/mol
Exact Mass139.99
IUPAC Nameaminooxymethyl-methoxy-sulfanylidenephosphanium
SMILESCO[P+](=S)CON
InChIInChI=1S/C2H7NO2PS/c1-4-6(7)2-5-3/h2-3H2,1H3/q+1
InChIKeyMSNCSTJLQQNWJL-UHFFFAOYSA-N
XLogP0.34
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.12
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methoxy-(methoxymethyl)-oxophosphanium
CID 87383663
aluminum tris(methoxy-oxido-oxophosphanium)
CID 160728321
CID 159864860
CID 159864860
hydroxy-methoxy-oxophosphanium;propanamide
CID 158251379
dimethoxy(oxo)phosphanium;hydron
CID 174585571
acetaldehyde;O-methylhydroxylamine
CID 157249940
dimethoxymethyl-methoxy-oxophosphanium
CID 12601973
dimethoxyphosphorylmethanamine
CID 13310504
1-aminooxypropan-2-one
CID 20700160
methoxy-oxo-(2,2,2-trifluoro-1-methoxyethyl)phosphanium
CID 130464327
O-[propoxy(silyl)phosphoryl]hydroxylamine
CID 175426852
methanol;O-methylhydroxylamine
CID 161209502

Frequently Asked Questions

What is the IUPAC name of aminooxymethyl-methoxy-sulfanylidenephosphanium?
The IUPAC name of aminooxymethyl-methoxy-sulfanylidenephosphanium (CID 163571316) is aminooxymethyl-methoxy-sulfanylidenephosphanium.
What is the SMILES notation for aminooxymethyl-methoxy-sulfanylidenephosphanium?
The canonical SMILES for aminooxymethyl-methoxy-sulfanylidenephosphanium is CO[P+](=S)CON.
What is the InChIKey of aminooxymethyl-methoxy-sulfanylidenephosphanium?
The InChIKey is MSNCSTJLQQNWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO2PS/c1-4-6(7)2-5-3/h2-3H2,1H3/q+1.
What are the key properties of aminooxymethyl-methoxy-sulfanylidenephosphanium?
aminooxymethyl-methoxy-sulfanylidenephosphanium has a molecular weight of 140.12 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for aminooxymethyl-methoxy-sulfanylidenephosphanium is sourced from PubChem (CID 163571316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).