(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol

C16H32O2Si — CID 138983935

IUPAC(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol
SMILESCC(C)[Si](/C=C(\CO)C1CCCO1)(C(C)C)C(C)C
InChIInChI=1S/C16H32O2Si/c1-12(2)19(13(3)4,14(5)6)11-15(10-17)16-8-7-9-18-16/h11-14,16-17H,7-10H2,1-6H3/b15-11+
InChIKeyYNYMXZYOCBQLRI-RVDMUPIBSA-N
MW284.52 g/mol
LogP4.30
Rot. Bonds6

About (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol

(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol (PubChem CID 138983935) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol.

Molecular Properties

Compound Name(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol
PubChem CID138983935
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol
SMILESCC(C)[Si](/C=C(\CO)C1CCCO1)(C(C)C)C(C)C
InChIInChI=1S/C16H32O2Si/c1-12(2)19(13(3)4,14(5)6)11-15(10-17)16-8-7-9-18-16/h11-14,16-17H,7-10H2,1-6H3/b15-11+
InChIKeyYNYMXZYOCBQLRI-RVDMUPIBSA-N
XLogP4.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(2R)-oxan-2-yl]-1-trimethylsilylprop-2-en-1-ol
CID 10375963
(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol
CID 102001453

Frequently Asked Questions

What is the IUPAC name of (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol?
The IUPAC name of (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol (CID 138983935) is (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol.
What is the SMILES notation for (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol?
The canonical SMILES for (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol is CC(C)[Si](/C=C(\CO)C1CCCO1)(C(C)C)C(C)C.
What is the InChIKey of (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol?
The InChIKey is YNYMXZYOCBQLRI-RVDMUPIBSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-12(2)19(13(3)4,14(5)6)11-15(10-17)16-8-7-9-18-16/h11-14,16-17H,7-10H2,1-6H3/b15-11+.
What are the key properties of (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol?
(E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol has a molecular weight of 284.52 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol is sourced from PubChem (CID 138983935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).