tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane

C24H44O6Si — CID 146018811

IUPACtert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane
SMILESC=CCO[C@H]1[C@H](OCC=C)[C@@H](OCC=C)C(OC(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H44O6Si/c1-11-14-25-20-19(17-28-31(9,10)24(6,7)8)30-23(29-18(4)5)22(27-16-13-3)21(20)26-15-12-2/h11-13,18-23H,1-3,14-17H2,4-10H3/t19-,20-,21+,22-,23?/m1/s1
InChIKeyYALAKVVNNCFFLI-HZQGQDIUSA-N
MW456.70 g/mol
LogP4.87
Rot. Bonds14

About tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane

tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane (PubChem CID 146018811) has the molecular formula C24H44O6Si and a molecular weight of 456.70 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane
PubChem CID146018811
Molecular FormulaC24H44O6Si
Molecular Weight456.70 g/mol
Exact Mass456.29
IUPAC Nametert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane
SMILESC=CCO[C@H]1[C@H](OCC=C)[C@@H](OCC=C)C(OC(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H44O6Si/c1-11-14-25-20-19(17-28-31(9,10)24(6,7)8)30-23(29-18(4)5)22(27-16-13-3)21(20)26-15-12-2/h11-13,18-23H,1-3,14-17H2,4-10H3/t19-,20-,21+,22-,23?/m1/s1
InChIKeyYALAKVVNNCFFLI-HZQGQDIUSA-N
XLogP4.87
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.70
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

(2S,3R,4S,5R,6R)-2-methoxy-3,4,5-tris(prop-2-enoxy)-6-(prop-2-enoxymethyl)oxane
CID 10871930
(2S,3R,4S,5R,6R)-2,3,4,5-tetrakis(prop-2-enoxy)-6-(prop-2-enoxymethyl)oxane
CID 10883420
2,3,4,5-Tetrakis-(allyloxy)-6-allyloxymethyl-tetrahydro-pyran
CID 18359776
(2R,3R,4S,5R,6R)-2,3,4,5-tetrakis(allyloxy)-6-((allyloxy)methyl)tetrahydro-2H-pyran
CID 18392544
(2S,3R,4S,5S,6R)-2-ethoxy-3,4,5-tris(prop-2-enoxy)-6-(prop-2-enoxymethyl)oxane
CID 69026792
TBDMS(-2)[TBDMS(-3)][TBDMS(-6)]Glc4F(a)-O-allyl
CID 140966535
[(3aR,6R,7S,7aR)-2,2-dimethyl-6-prop-2-enoxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy-tert-butyl-dimethylsilane
CID 10991555
(2S,3R,4S,5S,6R)-2-methoxy-3,4,5-tris(prop-2-enoxy)-6-(prop-2-enoxymethyl)oxane
CID 14729598
[(2R,3S,4R,6S)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-6-propa-1,2-dienoxyoxan-2-yl]methoxy-tert-butyl-dimethylsilane
CID 25136403
[(3R,6S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-6-methoxy-2-methyloxan-3-yl] (E)-but-2-enoate
CID 134835383
(3S,6S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-prop-2-enoxyoxane-3,4,5-triol
CID 134852829
[(3R,4S,6S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-6-methoxy-2-methyloxan-3-yl] prop-2-enoate
CID 134867143

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane (CID 146018811) is tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane is C=CCO[C@H]1[C@H](OCC=C)[C@@H](OCC=C)C(OC(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane?
The InChIKey is YALAKVVNNCFFLI-HZQGQDIUSA-N. The full InChI is InChI=1S/C24H44O6Si/c1-11-14-25-20-19(17-28-31(9,10)24(6,7)8)30-23(29-18(4)5)22(27-16-13-3)21(20)26-15-12-2/h11-13,18-23H,1-3,14-17H2,4-10H3/t19-,20-,21+,22-,23?/m1/s1.
What are the key properties of tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane?
tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane has a molecular weight of 456.70 g/mol, XLogP of 4.87, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(2R,3R,4S,5R)-6-propan-2-yloxy-3,4,5-tris(prop-2-enoxy)oxan-2-yl]methoxy]silane is sourced from PubChem (CID 146018811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).