triethoxy(3-thiophosphorosooxypropyl)silane

C9H21O4PSSi — CID 175204261

IUPACtriethoxy(3-thiophosphorosooxypropyl)silane
SMILESCCO[Si](CCCOP=S)(OCC)OCC
InChIInChI=1S/C9H21O4PSSi/c1-4-11-16(12-5-2,13-6-3)9-7-8-10-14-15/h4-9H2,1-3H3
InChIKeyPFYFHQDGKIBLGC-UHFFFAOYSA-N
MW284.39 g/mol
LogP2.76
Rot. Bonds11

About triethoxy(3-thiophosphorosooxypropyl)silane

triethoxy(3-thiophosphorosooxypropyl)silane (PubChem CID 175204261) has the molecular formula C9H21O4PSSi and a molecular weight of 284.39 g/mol. Its IUPAC name is triethoxy(3-thiophosphorosooxypropyl)silane.

Molecular Properties

Compound Nametriethoxy(3-thiophosphorosooxypropyl)silane
PubChem CID175204261
Molecular FormulaC9H21O4PSSi
Molecular Weight284.39 g/mol
Exact Mass284.07
IUPAC Nametriethoxy(3-thiophosphorosooxypropyl)silane
SMILESCCO[Si](CCCOP=S)(OCC)OCC
InChIInChI=1S/C9H21O4PSSi/c1-4-11-16(12-5-2,13-6-3)9-7-8-10-14-15/h4-9H2,1-3H3
InChIKeyPFYFHQDGKIBLGC-UHFFFAOYSA-N
XLogP2.76
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

triethoxy-[3-(3-triethoxysilylpropoxy)propyl]silane
CID 22616805
triethoxy-[3-[2-(3-triethoxysilylpropoxy)ethoxy]propyl]silane
CID 90147860
triethoxy(3-methoxypropyl)silane
CID 22712922
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
O-(3-triethoxysilylpropyl) carbamothioate
CID 175061210
triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane
CID 175020399
3-(3-triethoxysilylpropoxy)propan-1-amine
CID 54154158
CID 159843563
CID 159843563
triethoxy-[3-[silyl(3-triethoxysilylpropyl)silyl]propyl]silane
CID 162102309
dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(henicosyl)silane
CID 141362894
tetrakis[3-[tris(2-triethoxysilylethyl)silyl]propyl]silane
CID 101061227

Frequently Asked Questions

What is the IUPAC name of triethoxy(3-thiophosphorosooxypropyl)silane?
The IUPAC name of triethoxy(3-thiophosphorosooxypropyl)silane (CID 175204261) is triethoxy(3-thiophosphorosooxypropyl)silane.
What is the SMILES notation for triethoxy(3-thiophosphorosooxypropyl)silane?
The canonical SMILES for triethoxy(3-thiophosphorosooxypropyl)silane is CCO[Si](CCCOP=S)(OCC)OCC.
What is the InChIKey of triethoxy(3-thiophosphorosooxypropyl)silane?
The InChIKey is PFYFHQDGKIBLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21O4PSSi/c1-4-11-16(12-5-2,13-6-3)9-7-8-10-14-15/h4-9H2,1-3H3.
What are the key properties of triethoxy(3-thiophosphorosooxypropyl)silane?
triethoxy(3-thiophosphorosooxypropyl)silane has a molecular weight of 284.39 g/mol, XLogP of 2.76, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(3-thiophosphorosooxypropyl)silane is sourced from PubChem (CID 175204261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).