(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol

C22H30O3Si — CID 162405784

IUPAC(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol
SMILESC=CCO[C@H](CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C22H30O3Si/c1-5-16-24-19(17-23)18-25-26(22(2,3)4,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h5-15,19,23H,1,16-18H2,2-4H3/t19-/m1/s1
InChIKeyOLCBQLJHZALPNY-LJQANCHMSA-N
MW370.57 g/mol
LogP3.13
Rot. Bonds9

About (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol

(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol (PubChem CID 162405784) has the molecular formula C22H30O3Si and a molecular weight of 370.57 g/mol. Its IUPAC name is (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol.

Molecular Properties

Compound Name(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol
PubChem CID162405784
Molecular FormulaC22H30O3Si
Molecular Weight370.57 g/mol
Exact Mass370.20
IUPAC Name(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol
SMILESC=CCO[C@H](CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C22H30O3Si/c1-5-16-24-19(17-23)18-25-26(22(2,3)4,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h5-15,19,23H,1,16-18H2,2-4H3/t19-/m1/s1
InChIKeyOLCBQLJHZALPNY-LJQANCHMSA-N
XLogP3.13
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.57
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol?
The IUPAC name of (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol (CID 162405784) is (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol.
What is the SMILES notation for (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol?
The canonical SMILES for (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol is C=CCO[C@H](CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol?
The InChIKey is OLCBQLJHZALPNY-LJQANCHMSA-N. The full InChI is InChI=1S/C22H30O3Si/c1-5-16-24-19(17-23)18-25-26(22(2,3)4,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h5-15,19,23H,1,16-18H2,2-4H3/t19-/m1/s1.
What are the key properties of (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol?
(2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol has a molecular weight of 370.57 g/mol, XLogP of 3.13, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-[tert-butyl(diphenyl)silyl]oxy-2-prop-2-enoxypropan-1-ol is sourced from PubChem (CID 162405784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).