[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium

C27H35O2SiU- — CID 134864537

IUPAC[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium
SMILESC=CC[C@@H]1[C@@H](CC=C)[CH-]O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.[U]
InChIInChI=1S/C27H35O2Si.U/c1-6-14-22-20-28-26(25(22)15-7-2)21-29-30(27(3,4)5,23-16-10-8-11-17-23)24-18-12-9-13-19-24;/h6-13,16-20,22,25-26H,1-2,14-15,21H2,3-5H3;/q-1;/t22-,25+,26+;/m0./s1
InChIKeyJKCILYFSCWKDAT-OXVBVUJASA-N
MW657.69 g/mol
LogP5.51
Rot. Bonds9

About [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium

[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium (PubChem CID 134864537) has the molecular formula C27H35O2SiU- and a molecular weight of 657.69 g/mol. Its IUPAC name is [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium.

Molecular Properties

Compound Name[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium
PubChem CID134864537
Molecular FormulaC27H35O2SiU-
Molecular Weight657.69 g/mol
Exact Mass657.29
IUPAC Name[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium
SMILESC=CC[C@@H]1[C@@H](CC=C)[CH-]O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.[U]
InChIInChI=1S/C27H35O2Si.U/c1-6-14-22-20-28-26(25(22)15-7-2)21-29-30(27(3,4)5,23-16-10-8-11-17-23)24-18-12-9-13-19-24;/h6-13,16-20,22,25-26H,1-2,14-15,21H2,3-5H3;/q-1;/t22-,25+,26+;/m0./s1
InChIKeyJKCILYFSCWKDAT-OXVBVUJASA-N
XLogP5.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500657.69
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium?
The IUPAC name of [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium (CID 134864537) is [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium.
What is the SMILES notation for [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium?
The canonical SMILES for [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium is C=CC[C@@H]1[C@@H](CC=C)[CH-]O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.[U].
What is the InChIKey of [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium?
The InChIKey is JKCILYFSCWKDAT-OXVBVUJASA-N. The full InChI is InChI=1S/C27H35O2Si.U/c1-6-14-22-20-28-26(25(22)15-7-2)21-29-30(27(3,4)5,23-16-10-8-11-17-23)24-18-12-9-13-19-24;/h6-13,16-20,22,25-26H,1-2,14-15,21H2,3-5H3;/q-1;/t22-,25+,26+;/m0./s1.
What are the key properties of [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium?
[(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium has a molecular weight of 657.69 g/mol, XLogP of 5.51, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3R,4R)-3,4-bis(prop-2-enyl)-2,3,4,5-tetrahydrofuran-5-id-2-yl]methoxy-tert-butyl-diphenylsilane;uranium is sourced from PubChem (CID 134864537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).