propan-2-yloxy(propyl)phosphinite

C6H14O2P- — CID 18981653

IUPACpropan-2-yloxy(propyl)phosphinite
SMILESCCCP([O-])OC(C)C
InChIInChI=1S/C6H14O2P/c1-4-5-9(7)8-6(2)3/h6H,4-5H2,1-3H3/q-1
InChIKeyGCYOOMFONNHHGX-UHFFFAOYSA-N
MW149.15 g/mol
LogP1.49
Rot. Bonds4

About propan-2-yloxy(propyl)phosphinite

propan-2-yloxy(propyl)phosphinite (PubChem CID 18981653) has the molecular formula C6H14O2P- and a molecular weight of 149.15 g/mol. Its IUPAC name is propan-2-yloxy(propyl)phosphinite.

Molecular Properties

Compound Namepropan-2-yloxy(propyl)phosphinite
PubChem CID18981653
Molecular FormulaC6H14O2P-
Molecular Weight149.15 g/mol
Exact Mass149.07
IUPAC Namepropan-2-yloxy(propyl)phosphinite
SMILESCCCP([O-])OC(C)C
InChIInChI=1S/C6H14O2P/c1-4-5-9(7)8-6(2)3/h6H,4-5H2,1-3H3/q-1
InChIKeyGCYOOMFONNHHGX-UHFFFAOYSA-N
XLogP1.49
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of propan-2-yloxy(propyl)phosphinite?
The IUPAC name of propan-2-yloxy(propyl)phosphinite (CID 18981653) is propan-2-yloxy(propyl)phosphinite.
What is the SMILES notation for propan-2-yloxy(propyl)phosphinite?
The canonical SMILES for propan-2-yloxy(propyl)phosphinite is CCCP([O-])OC(C)C.
What is the InChIKey of propan-2-yloxy(propyl)phosphinite?
The InChIKey is GCYOOMFONNHHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2P/c1-4-5-9(7)8-6(2)3/h6H,4-5H2,1-3H3/q-1.
What are the key properties of propan-2-yloxy(propyl)phosphinite?
propan-2-yloxy(propyl)phosphinite has a molecular weight of 149.15 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yloxy(propyl)phosphinite is sourced from PubChem (CID 18981653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).