(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol

C12H24O4Si — CID 134971279

IUPAC(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol
SMILESCC1OC=CC(OCOCC[Si](C)(C)C)[C@@H]1O
InChIInChI=1S/C12H24O4Si/c1-10-12(13)11(5-6-15-10)16-9-14-7-8-17(2,3)4/h5-6,10-13H,7-9H2,1-4H3/t10?,11?,12-/m1/s1
InChIKeyFFRNWXDHTIPJIR-HTAVTVPLSA-N
MW260.41 g/mol
LogP1.98
Rot. Bonds6

About (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol

(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol (PubChem CID 134971279) has the molecular formula C12H24O4Si and a molecular weight of 260.41 g/mol. Its IUPAC name is (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol.

Molecular Properties

Compound Name(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol
PubChem CID134971279
Molecular FormulaC12H24O4Si
Molecular Weight260.41 g/mol
Exact Mass260.14
IUPAC Name(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol
SMILESCC1OC=CC(OCOCC[Si](C)(C)C)[C@@H]1O
InChIInChI=1S/C12H24O4Si/c1-10-12(13)11(5-6-15-10)16-9-14-7-8-17(2,3)4/h5-6,10-13H,7-9H2,1-4H3/t10?,11?,12-/m1/s1
InChIKeyFFRNWXDHTIPJIR-HTAVTVPLSA-N
XLogP1.98
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-tert-Butyldimethylsilanyloxy)-4-(2-methoxyethoxymethoxy)hex-5-en-3-ol
CID 46894690
(3S)-2-methyl-3-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-4-ol
CID 134855216
(2R,3S,4R)-2-butylsilyloxy-4-ethenoxy-3,4-dihydro-2H-pyran-3-ol
CID 174092446
(1R,2S)-1-[(2R,3R)-3-methyloxiran-2-yl]-2-(2-trimethylsilylethoxymethoxy)but-3-en-1-ol
CID 10869506
(3S,4S,6S)-6-[tert-butyl(dimethyl)silyl]oxy-3-(methoxymethoxy)hept-1-en-4-ol
CID 11709271
(3R,4R)-4-(2-trimethylsilylethoxymethoxy)hex-5-en-3-ol
CID 11791487
[(2R,3S)-3-(2-methoxyethoxymethoxy)-2,3-dihydrofuran-2-yl]methanol
CID 21668285
(2R,3S,4S)-2-(hydroxymethyl)-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol
CID 23255675
[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
CID 53362330
(1S)-1-[(2R,3R,5S,6S)-3-ethenyl-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]-3-trimethylsilylprop-2-yn-1-ol
CID 101386413

Frequently Asked Questions

What is the IUPAC name of (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol?
The IUPAC name of (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol (CID 134971279) is (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol.
What is the SMILES notation for (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol?
The canonical SMILES for (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol is CC1OC=CC(OCOCC[Si](C)(C)C)[C@@H]1O.
What is the InChIKey of (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol?
The InChIKey is FFRNWXDHTIPJIR-HTAVTVPLSA-N. The full InChI is InChI=1S/C12H24O4Si/c1-10-12(13)11(5-6-15-10)16-9-14-7-8-17(2,3)4/h5-6,10-13H,7-9H2,1-4H3/t10?,11?,12-/m1/s1.
What are the key properties of (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol?
(3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol has a molecular weight of 260.41 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-methyl-4-(2-trimethylsilylethoxymethoxy)-3,4-dihydro-2H-pyran-3-ol is sourced from PubChem (CID 134971279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).