(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol

C19H26O3Si — CID 10687900

IUPAC(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol
SMILESCC(C)(C)[Si](OC[C@H](O)CO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H26O3Si/c1-19(2,3)23(22-15-16(21)14-20,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,20-21H,14-15H2,1-3H3/t16-/m1/s1
InChIKeyRYZYNNLPABISLU-MRXNPFEDSA-N
MW330.50 g/mol
LogP1.92
Rot. Bonds6

About (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol

(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol (PubChem CID 10687900) has the molecular formula C19H26O3Si and a molecular weight of 330.50 g/mol. Its IUPAC name is (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol.

Molecular Properties

Compound Name(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol
PubChem CID10687900
Molecular FormulaC19H26O3Si
Molecular Weight330.50 g/mol
Exact Mass330.17
IUPAC Name(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol
SMILESCC(C)(C)[Si](OC[C@H](O)CO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H26O3Si/c1-19(2,3)23(22-15-16(21)14-20,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,20-21H,14-15H2,1-3H3/t16-/m1/s1
InChIKeyRYZYNNLPABISLU-MRXNPFEDSA-N
XLogP1.92
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol?
The IUPAC name of (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol (CID 10687900) is (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol.
What is the SMILES notation for (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol?
The canonical SMILES for (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol is CC(C)(C)[Si](OC[C@H](O)CO)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol?
The InChIKey is RYZYNNLPABISLU-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H26O3Si/c1-19(2,3)23(22-15-16(21)14-20,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,20-21H,14-15H2,1-3H3/t16-/m1/s1.
What are the key properties of (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol?
(2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol has a molecular weight of 330.50 g/mol, XLogP of 1.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-[tert-butyl(diphenyl)silyl]oxypropane-1,2-diol is sourced from PubChem (CID 10687900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).