tris(3-ethoxypropyl) phosphite

C15H33O6P — CID 54497287

IUPACtris(3-ethoxypropyl) phosphite
SMILESCCOCCCOP(OCCCOCC)OCCCOCC
InChIInChI=1S/C15H33O6P/c1-4-16-10-7-13-19-22(20-14-8-11-17-5-2)21-15-9-12-18-6-3/h4-15H2,1-3H3
InChIKeyXZZVAINYSPHORC-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.54
Rot. Bonds18

About tris(3-ethoxypropyl) phosphite

tris(3-ethoxypropyl) phosphite (PubChem CID 54497287) has the molecular formula C15H33O6P and a molecular weight of 340.40 g/mol. Its IUPAC name is tris(3-ethoxypropyl) phosphite.

Molecular Properties

Compound Nametris(3-ethoxypropyl) phosphite
PubChem CID54497287
Molecular FormulaC15H33O6P
Molecular Weight340.40 g/mol
Exact Mass340.20
IUPAC Nametris(3-ethoxypropyl) phosphite
SMILESCCOCCCOP(OCCCOCC)OCCCOCC
InChIInChI=1S/C15H33O6P/c1-4-16-10-7-13-19-22(20-14-8-11-17-5-2)21-15-9-12-18-6-3/h4-15H2,1-3H3
InChIKeyXZZVAINYSPHORC-UHFFFAOYSA-N
XLogP3.54
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxy-3-(3-ethoxypropoxymethoxy)propane;methane
CID 165051795
3-ethoxypropoxyphosphane
CID 57317096
triheptadecyl phosphite
CID 23435031
ethane;1-ethoxybutane
CID 143206406
1-(3-ethoxypropoxy)-4-methoxybutane
CID 59660847
1-(3-ethoxypropoxy)tetradecane
CID 91693148
1-(3-ethoxypropylperoxy)butane
CID 154387522
chlororuthenium;tris(tributyl phosphite)
CID 173315437
pentakis(3-ethoxypropoxy)-λ5-stibane
CID 139727092
3-[2-(3-ethoxypropoxy)ethoxy]propan-1-ol
CID 88558917
1,2-diethoxyethane;hydrofluoride
CID 175535770
1-(3-ethoxypropoxy)-4-methanidyloxybutane;yttrium
CID 59660846

Frequently Asked Questions

What is the IUPAC name of tris(3-ethoxypropyl) phosphite?
The IUPAC name of tris(3-ethoxypropyl) phosphite (CID 54497287) is tris(3-ethoxypropyl) phosphite.
What is the SMILES notation for tris(3-ethoxypropyl) phosphite?
The canonical SMILES for tris(3-ethoxypropyl) phosphite is CCOCCCOP(OCCCOCC)OCCCOCC.
What is the InChIKey of tris(3-ethoxypropyl) phosphite?
The InChIKey is XZZVAINYSPHORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33O6P/c1-4-16-10-7-13-19-22(20-14-8-11-17-5-2)21-15-9-12-18-6-3/h4-15H2,1-3H3.
What are the key properties of tris(3-ethoxypropyl) phosphite?
tris(3-ethoxypropyl) phosphite has a molecular weight of 340.40 g/mol, XLogP of 3.54, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(3-ethoxypropyl) phosphite is sourced from PubChem (CID 54497287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).