5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane

C23H40O3Si — CID 11574697

IUPAC5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane
SMILESC=C[C@H](OCOC)[C@@H]1C=C[C@@H](CCCC#C[Si](C(C)C)(C(C)C)C(C)C)O1
InChIInChI=1S/C23H40O3Si/c1-9-22(25-17-24-8)23-15-14-21(26-23)13-11-10-12-16-27(18(2)3,19(4)5)20(6)7/h9,14-15,18-23H,1,10-11,13,17H2,2-8H3/t21-,22+,23+/m1/s1
InChIKeyGWVDRIAKDKBDAX-VJBWXMMDSA-N
MW392.66 g/mol
LogP5.88
Rot. Bonds11

About 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane

5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane (PubChem CID 11574697) has the molecular formula C23H40O3Si and a molecular weight of 392.66 g/mol. Its IUPAC name is 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Name5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane
PubChem CID11574697
Molecular FormulaC23H40O3Si
Molecular Weight392.66 g/mol
Exact Mass392.27
IUPAC Name5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane
SMILESC=C[C@H](OCOC)[C@@H]1C=C[C@@H](CCCC#C[Si](C(C)C)(C(C)C)C(C)C)O1
InChIInChI=1S/C23H40O3Si/c1-9-22(25-17-24-8)23-15-14-21(26-23)13-11-10-12-16-27(18(2)3,19(4)5)20(6)7/h9,14-15,18-23H,1,10-11,13,17H2,2-8H3/t21-,22+,23+/m1/s1
InChIKeyGWVDRIAKDKBDAX-VJBWXMMDSA-N
XLogP5.88
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.66
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

tri(propan-2-yl)-[2-[(2R,6R)-6-propan-2-yloxy-3,6-dihydro-2H-pyran-2-yl]ethynyl]silane
CID 11267255
triethyl-[(3S,4S,5E)-7-prop-2-enoxy-4-[(3R)-8-tri(propan-2-yl)silyloct-1-en-7-yn-3-yl]oxyhepta-1,5-dien-3-yl]oxysilane
CID 11613803
2-[(2R)-6-ethoxy-3,6-dihydro-2H-pyran-2-yl]ethynyl-tri(propan-2-yl)silane
CID 44556775
triethyl-[(3R,4S,5E)-7-prop-2-enoxy-4-[(3R)-8-tri(propan-2-yl)silyloct-1-en-7-yn-3-yl]oxyhepta-1,5-dien-3-yl]oxysilane
CID 134939457
5-[(2R,5S)-5-[(1R)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane
CID 134939458
CID 58805457
CID 58805457
3-[(2R,3S,6R)-6-(1,3-dioxolan-2-ylmethyl)-3-methoxy-3,6-dihydro-2H-pyran-2-yl]prop-1-ynyl-trimethylsilane
CID 59026925
3-[6-(1,3-dioxolan-2-ylmethyl)-3-methoxy-3,6-dihydro-2H-pyran-2-yl]prop-1-ynyl-trimethylsilane
CID 68714309
4-Hept-1-enyl-5-[6-(2-methoxypropan-2-yloxy)oct-7-en-2,4-diynyl]-2,2-dimethyl-1,3-dioxolane
CID 139609816
tert-butyl-[(3S)-7-[(4R,5S)-2,2-dimethyl-5-[(E)-oct-1-enyl]-1,3-dioxolan-4-yl]hepta-4,6-diyn-3-yl]oxy-dimethylsilane
CID 169104123
tert-butyl-[(3S)-7-[(4S,5R)-2,2-dimethyl-5-[(E)-oct-1-enyl]-1,3-dioxolan-4-yl]hepta-4,6-diyn-3-yl]oxy-dimethylsilane
CID 169104125
tert-butyl-[(3S)-7-[(4R,5R)-2,2-dimethyl-5-[(E)-oct-1-enyl]-1,3-dioxolan-4-yl]hepta-4,6-diyn-3-yl]oxy-dimethylsilane
CID 169104137

Frequently Asked Questions

What is the IUPAC name of 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane?
The IUPAC name of 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane (CID 11574697) is 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane.
What is the SMILES notation for 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane?
The canonical SMILES for 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane is C=C[C@H](OCOC)[C@@H]1C=C[C@@H](CCCC#C[Si](C(C)C)(C(C)C)C(C)C)O1.
What is the InChIKey of 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane?
The InChIKey is GWVDRIAKDKBDAX-VJBWXMMDSA-N. The full InChI is InChI=1S/C23H40O3Si/c1-9-22(25-17-24-8)23-15-14-21(26-23)13-11-10-12-16-27(18(2)3,19(4)5)20(6)7/h9,14-15,18-23H,1,10-11,13,17H2,2-8H3/t21-,22+,23+/m1/s1.
What are the key properties of 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane?
5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane has a molecular weight of 392.66 g/mol, XLogP of 5.88, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R,5S)-5-[(1S)-1-(methoxymethoxy)prop-2-enyl]-2,5-dihydrofuran-2-yl]pent-1-ynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 11574697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).