(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol

C24H22F2O3 — CID 123952191

IUPAC(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol
SMILESOC1O[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)CC1(F)F
InChIInChI=1S/C24H22F2O3/c25-23(26)16-21(29-22(23)27)17-28-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22,27H,16-17H2/t21-,22?/m1/s1
InChIKeySUASARISVMZSMN-ZMFCMNQTSA-N
MW396.43 g/mol
LogP4.74
Rot. Bonds6

About (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol

(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol (PubChem CID 123952191) has the molecular formula C24H22F2O3 and a molecular weight of 396.43 g/mol. Its IUPAC name is (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol.

Molecular Properties

Compound Name(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol
PubChem CID123952191
Molecular FormulaC24H22F2O3
Molecular Weight396.43 g/mol
Exact Mass396.15
IUPAC Name(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol
SMILESOC1O[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)CC1(F)F
InChIInChI=1S/C24H22F2O3/c25-23(26)16-21(29-22(23)27)17-28-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22,27H,16-17H2/t21-,22?/m1/s1
InChIKeySUASARISVMZSMN-ZMFCMNQTSA-N
XLogP4.74
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.43
LogP ≤ 54.74
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

(2S,3S,5S)-3-fluoro-5-(trityloxymethyl)oxolan-2-ol
CID 14859660
(2R,3R,5R)-2-methoxy-5-(trityloxymethyl)oxolan-3-ol
CID 178184681
(2S,4S,5R)-5-(trityloxymethyl)oxolane-2,4-diol
CID 171126516
(3S,5S)-3-hydroxy-5-(trityloxymethyl)oxolan-2-one
CID 15478722
(5S)-3-(benzenesulfinyl)-3-fluoro-5-(trityloxymethyl)oxolan-2-one
CID 11364066
3-(trityloxymethyl)cyclobutan-1-ol
CID 14796870
4-(trityloxymethyl)trioxolane
CID 19758940
2-(trityloxymethyl)oxane-3,4,5-triol
CID 73104798
(2S,3R,4R)-2-(trityloxymethyl)oxolane-3,4-diol
CID 101240446
(2S,3S,4S,5R,6R)-5-fluoro-6-(trityloxymethyl)oxane-2,3,4-triol
CID 171123594
(2R,6R)-2-methoxy-6-(trityloxymethyl)oxane
CID 56627536
2-[(4R,6S)-2,2-dimethyl-6-(trityloxymethyl)-1,3-dioxan-4-yl]acetic acid
CID 18716197

Frequently Asked Questions

What is the IUPAC name of (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol?
The IUPAC name of (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol (CID 123952191) is (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol.
What is the SMILES notation for (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol?
The canonical SMILES for (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol is OC1O[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)CC1(F)F.
What is the InChIKey of (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol?
The InChIKey is SUASARISVMZSMN-ZMFCMNQTSA-N. The full InChI is InChI=1S/C24H22F2O3/c25-23(26)16-21(29-22(23)27)17-28-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22,27H,16-17H2/t21-,22?/m1/s1.
What are the key properties of (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol?
(5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol has a molecular weight of 396.43 g/mol, XLogP of 4.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3,3-difluoro-5-(trityloxymethyl)oxolan-2-ol is sourced from PubChem (CID 123952191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).