[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane

C16H32O6Si — CID 50901696

IUPAC[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCOCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O6Si/c1-16(2,3)23(6,7)22-10-14-15(21-12-18-5)13(8-9-19-14)20-11-17-4/h8-9,13-15H,10-12H2,1-7H3/t13-,14-,15+/m1/s1
InChIKeyDROQTCPLSRFANU-KFWWJZLASA-N
MW348.51 g/mol
LogP2.90
Rot. Bonds9

About [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane

[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane (PubChem CID 50901696) has the molecular formula C16H32O6Si and a molecular weight of 348.51 g/mol. Its IUPAC name is [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane
PubChem CID50901696
Molecular FormulaC16H32O6Si
Molecular Weight348.51 g/mol
Exact Mass348.20
IUPAC Name[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCOCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O6Si/c1-16(2,3)23(6,7)22-10-14-15(21-12-18-5)13(8-9-19-14)20-11-17-4/h8-9,13-15H,10-12H2,1-7H3/t13-,14-,15+/m1/s1
InChIKeyDROQTCPLSRFANU-KFWWJZLASA-N
XLogP2.90
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.51
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Tri-O-(tert-butyldimethylsilyl)-D-glucal
CID 10648718
(3aR,4R,7aR)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-4,7a-dihydro-3aH-[1,3]dioxolo[4,5-c]pyran-2-one
CID 11129896
[(4aR,8R,8aR)-2,2-dimethyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy-tri(propan-2-yl)silane
CID 11462014
3-O-Tert-butyldimethylsilyl-4,6-O-isopropylidene-D-glucal
CID 14352117
1-tert-Butyldimethylsilanyloxy)-4-(2-methoxyethoxymethoxy)hex-5-en-3-ol
CID 46894690
[(2R,3S,4R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane
CID 101106917
[(2R,3R,4S)-3-[[(2R,3R,4S)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methyl-3,4-dihydro-2H-pyran-6-yl]oxy]-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy-tert-butyl-dimethylsilane
CID 134833862
tert-butyl-[(1R,2S,6S)-2-methoxy-6-(methoxymethoxy)-3-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane
CID 134836950
[(4aR,8R,8aS)-2,2-dimethyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy-tert-butyl-dimethylsilane
CID 134856099
tert-butyl-[1-[[(2S,3S,4S)-3-[1-[tert-butyl(dimethyl)silyl]oxyethenoxy]-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]ethenoxy]-dimethylsilane
CID 134882733
[(2R,3S,4R)-3-(methoxymethoxy)-6-tributylstannyl-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane
CID 134882794
tert-butyl-[1-[[(2S,3S,4R)-3-[1-[tert-butyl(dimethyl)silyl]oxyethenoxy]-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]ethenoxy]-dimethylsilane
CID 134882843

Frequently Asked Questions

What is the IUPAC name of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane (CID 50901696) is [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane is COCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is DROQTCPLSRFANU-KFWWJZLASA-N. The full InChI is InChI=1S/C16H32O6Si/c1-16(2,3)23(6,7)22-10-14-15(21-12-18-5)13(8-9-19-14)20-11-17-4/h8-9,13-15H,10-12H2,1-7H3/t13-,14-,15+/m1/s1.
What are the key properties of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane?
[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 348.51 g/mol, XLogP of 2.90, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 50901696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).