(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol

C17H34O4Si — CID 10782685

IUPAC(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol
SMILESC=CC[C@@]1(CO[Si](C(C)C)(C(C)C)C(C)C)OC[C@@H](O)[C@@H]1O
InChIInChI=1S/C17H34O4Si/c1-8-9-17(16(19)15(18)10-20-17)11-21-22(12(2)3,13(4)5)14(6)7/h8,12-16,18-19H,1,9-11H2,2-7H3/t15-,16+,17+/m1/s1
InChIKeyFBRMOJFAHRAGRM-IKGGRYGDSA-N
MW330.54 g/mol
LogP3.25
Rot. Bonds8

About (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol

(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol (PubChem CID 10782685) has the molecular formula C17H34O4Si and a molecular weight of 330.54 g/mol. Its IUPAC name is (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol.

Molecular Properties

Compound Name(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol
PubChem CID10782685
Molecular FormulaC17H34O4Si
Molecular Weight330.54 g/mol
Exact Mass330.22
IUPAC Name(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol
SMILESC=CC[C@@]1(CO[Si](C(C)C)(C(C)C)C(C)C)OC[C@@H](O)[C@@H]1O
InChIInChI=1S/C17H34O4Si/c1-8-9-17(16(19)15(18)10-20-17)11-21-22(12(2)3,13(4)5)14(6)7/h8,12-16,18-19H,1,9-11H2,2-7H3/t15-,16+,17+/m1/s1
InChIKeyFBRMOJFAHRAGRM-IKGGRYGDSA-N
XLogP3.25
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.54
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol with MolForge

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Launch Full Analysis

Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-2-[(4S,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]pent-4-en-2-ol
CID 135024857
[(2R,4S,5S)-4-[(4R,5R)-5-[tert-butyl(dimethyl)silyl]oxyhept-1-en-4-yl]oxy-5-prop-2-enyloxolan-2-yl]methanol
CID 138963627
[(2R,4R,5R)-4-prop-1-en-2-yl-5-[2-tri(propan-2-yl)silyloxyethyl]oxolan-2-yl]methanol
CID 10665039
(1R,2S)-1-[(2R,3R,4S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S)-1-hydroxybut-3-en-2-yl]-2-methyloxolan-2-yl]-2-methylpropane-1,3-diol
CID 57641041
CID 57720364
CID 57720364
(1S)-1-[(1R,3S,4S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-3-methyl-2,5-dioxabicyclo[2.2.1]heptan-1-yl]prop-2-en-1-ol
CID 57720377
(1S)-1-[(3S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-3-methyl-2,5-dioxabicyclo[2.2.1]heptan-1-yl]prop-2-en-1-ol
CID 57720403
(2S,3S)-2-[(4R,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]hex-5-en-3-ol
CID 59071276
CID 88579846
CID 88579846
CID 88579868
CID 88579868
(3R,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methoxy-3-prop-2-enyloxolan-3-ol
CID 89096983
CID 89222911
CID 89222911

Frequently Asked Questions

What is the IUPAC name of (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol?
The IUPAC name of (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol (CID 10782685) is (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol.
What is the SMILES notation for (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol?
The canonical SMILES for (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol is C=CC[C@@]1(CO[Si](C(C)C)(C(C)C)C(C)C)OC[C@@H](O)[C@@H]1O.
What is the InChIKey of (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol?
The InChIKey is FBRMOJFAHRAGRM-IKGGRYGDSA-N. The full InChI is InChI=1S/C17H34O4Si/c1-8-9-17(16(19)15(18)10-20-17)11-21-22(12(2)3,13(4)5)14(6)7/h8,12-16,18-19H,1,9-11H2,2-7H3/t15-,16+,17+/m1/s1.
What are the key properties of (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol?
(2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol has a molecular weight of 330.54 g/mol, XLogP of 3.25, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4R)-2-prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol is sourced from PubChem (CID 10782685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).