(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol

C15H32O3Si2 — CID 135073363

IUPAC(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol
SMILESC[C@]1([Si](C)(C)C)O[C@@H]1C[C@]1([Si](C)(C)C)OCCC[C@H]1O
InChIInChI=1S/C15H32O3Si2/c1-14(19(2,3)4)13(18-14)11-15(20(5,6)7)12(16)9-8-10-17-15/h12-13,16H,8-11H2,1-7H3/t12-,13-,14-,15-/m1/s1
InChIKeyBBMXAKNSELTXCP-KBUPBQIOSA-N
MW316.59 g/mol
LogP3.20
Rot. Bonds4

About (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol

(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol (PubChem CID 135073363) has the molecular formula C15H32O3Si2 and a molecular weight of 316.59 g/mol. Its IUPAC name is (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol.

Molecular Properties

Compound Name(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol
PubChem CID135073363
Molecular FormulaC15H32O3Si2
Molecular Weight316.59 g/mol
Exact Mass316.19
IUPAC Name(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol
SMILESC[C@]1([Si](C)(C)C)O[C@@H]1C[C@]1([Si](C)(C)C)OCCC[C@H]1O
InChIInChI=1S/C15H32O3Si2/c1-14(19(2,3)4)13(18-14)11-15(20(5,6)7)12(16)9-8-10-17-15/h12-13,16H,8-11H2,1-7H3/t12-,13-,14-,15-/m1/s1
InChIKeyBBMXAKNSELTXCP-KBUPBQIOSA-N
XLogP3.20
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.59
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol?
The IUPAC name of (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol (CID 135073363) is (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol.
What is the SMILES notation for (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol?
The canonical SMILES for (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol is C[C@]1([Si](C)(C)C)O[C@@H]1C[C@]1([Si](C)(C)C)OCCC[C@H]1O.
What is the InChIKey of (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol?
The InChIKey is BBMXAKNSELTXCP-KBUPBQIOSA-N. The full InChI is InChI=1S/C15H32O3Si2/c1-14(19(2,3)4)13(18-14)11-15(20(5,6)7)12(16)9-8-10-17-15/h12-13,16H,8-11H2,1-7H3/t12-,13-,14-,15-/m1/s1.
What are the key properties of (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol?
(2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol has a molecular weight of 316.59 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-[[(2R,3R)-3-methyl-3-trimethylsilyloxiran-2-yl]methyl]-2-trimethylsilyloxan-3-ol is sourced from PubChem (CID 135073363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).