(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol

C24H23FO3 — CID 14859660

IUPAC(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol
SMILESO[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@@H]1F
InChIInChI=1S/C24H23FO3/c25-22-16-21(28-23(22)26)17-27-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2/t21-,22-,23-/m0/s1
InChIKeyBYOCEAIVFDLTQX-VABKMULXSA-N
MW378.44 g/mol
LogP4.44
Rot. Bonds6

About (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol

(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol (PubChem CID 14859660) has the molecular formula C24H23FO3 and a molecular weight of 378.44 g/mol. Its IUPAC name is (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol.

Molecular Properties

Compound Name(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol
PubChem CID14859660
Molecular FormulaC24H23FO3
Molecular Weight378.44 g/mol
Exact Mass378.16
IUPAC Name(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol
SMILESO[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@@H]1F
InChIInChI=1S/C24H23FO3/c25-22-16-21(28-23(22)26)17-27-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2/t21-,22-,23-/m0/s1
InChIKeyBYOCEAIVFDLTQX-VABKMULXSA-N
XLogP4.44
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.44
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(2R,3R,5R)-2-methoxy-5-(trityloxymethyl)oxolan-3-ol
CID 178184681
(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol
CID 123952191
(2R,3S,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-fluorooxolan-2-ol
CID 90339346
(3S,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-fluorooxolan-2-ol
CID 101223113
(2S,4S,5R)-5-(trityloxymethyl)oxolane-2,4-diol
CID 171126516
(3S,5S)-3-hydroxy-5-(trityloxymethyl)oxolan-2-one
CID 15478722
(2S,3S,4S,5R,6R)-5-fluoro-6-(trityloxymethyl)oxane-2,3,4-triol
CID 171123594
3-(trityloxymethyl)cyclobutan-1-ol
CID 14796870
(1S,4R)-4-(trityloxymethyl)cyclopent-2-en-1-ol
CID 10021190
acetonitrile;(5S)-2,3-dimethyl-5-(trityloxymethyl)oxolane;propane-2,2-diol
CID 143157543
4-(trityloxymethyl)trioxolane
CID 19758940
(2R,3S,4R,6S)-6-methoxy-2-(trityloxymethyl)oxane-3,4-diol
CID 11811858

Frequently Asked Questions

What is the IUPAC name of (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol?
The IUPAC name of (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol (CID 14859660) is (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol.
What is the SMILES notation for (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol?
The canonical SMILES for (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol is O[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@@H]1F.
What is the InChIKey of (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol?
The InChIKey is BYOCEAIVFDLTQX-VABKMULXSA-N. The full InChI is InChI=1S/C24H23FO3/c25-22-16-21(28-23(22)26)17-27-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2/t21-,22-,23-/m0/s1.
What are the key properties of (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol?
(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol has a molecular weight of 378.44 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol is sourced from PubChem (CID 14859660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).