1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol

C9H20O3Si — CID 19823927

IUPAC1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol
SMILESC=CCOCC(O)CO[Si](C)(C)C
InChIInChI=1S/C9H20O3Si/c1-5-6-11-7-9(10)8-12-13(2,3)4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyZWTNBDLXARZKPV-UHFFFAOYSA-N
MW204.34 g/mol
LogP1.40
Rot. Bonds7

About 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol

1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol (PubChem CID 19823927) has the molecular formula C9H20O3Si and a molecular weight of 204.34 g/mol. Its IUPAC name is 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol.

Molecular Properties

Compound Name1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol
PubChem CID19823927
Molecular FormulaC9H20O3Si
Molecular Weight204.34 g/mol
Exact Mass204.12
IUPAC Name1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol
SMILESC=CCOCC(O)CO[Si](C)(C)C
InChIInChI=1S/C9H20O3Si/c1-5-6-11-7-9(10)8-12-13(2,3)4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyZWTNBDLXARZKPV-UHFFFAOYSA-N
XLogP1.40
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.34
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol?
The IUPAC name of 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol (CID 19823927) is 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol.
What is the SMILES notation for 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol?
The canonical SMILES for 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol is C=CCOCC(O)CO[Si](C)(C)C.
What is the InChIKey of 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol?
The InChIKey is ZWTNBDLXARZKPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O3Si/c1-5-6-11-7-9(10)8-12-13(2,3)4/h5,9-10H,1,6-8H2,2-4H3.
What are the key properties of 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol?
1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol has a molecular weight of 204.34 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enoxy-3-trimethylsilyloxypropan-2-ol is sourced from PubChem (CID 19823927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).