[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol

C12H25FO2Si — CID 16655222

IUPAC[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol
SMILESCC(C)(C)[Si](C)(C)OC[C@@]1(C)C[C@@]1(F)CO
InChIInChI=1S/C12H25FO2Si/c1-10(2,3)16(5,6)15-9-11(4)7-12(11,13)8-14/h14H,7-9H2,1-6H3/t11-,12-/m1/s1
InChIKeyIAEUWMXFMDLYPY-VXGBXAGGSA-N
MW248.41 g/mol
LogP3.12
Rot. Bonds4

About [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol

[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol (PubChem CID 16655222) has the molecular formula C12H25FO2Si and a molecular weight of 248.41 g/mol. Its IUPAC name is [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol.

Molecular Properties

Compound Name[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol
PubChem CID16655222
Molecular FormulaC12H25FO2Si
Molecular Weight248.41 g/mol
Exact Mass248.16
IUPAC Name[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol
SMILESCC(C)(C)[Si](C)(C)OC[C@@]1(C)C[C@@]1(F)CO
InChIInChI=1S/C12H25FO2Si/c1-10(2,3)16(5,6)15-9-11(4)7-12(11,13)8-14/h14H,7-9H2,1-6H3/t11-,12-/m1/s1
InChIKeyIAEUWMXFMDLYPY-VXGBXAGGSA-N
XLogP3.12
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
CID 59000904
1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclobutan-1-ol
CID 70362766
tert-butyl-chloro-dimethylsilane;[1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol;[1-(hydroxymethyl)cyclopropyl]methanol
CID 158962820
tert-butyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(hydroxymethyl)-2-azabicyclo[2.1.1]hexane-2-carboxylate
CID 174039842
[3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-methyloxiran-2-yl]methanol
CID 74036562
[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4H-dithiin-3-yl]methanol
CID 23367133
3-[[tert-butyl(dimethyl)silyl]oxymethyl]oxetan-3-amine
CID 171692296
[(1R,2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
CID 69296261
3-[tert-butyl(dimethyl)silyl]oxy-1,1,2,2,3,3-hexadeuteriopropan-1-ol
CID 71777166
2-[(3aR,4S,6R,6aS)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methoxy-2,2,6-trimethyl-3a,6a-dihydrofuro[3,4-d][1,3]dioxol-4-yl]ethanol
CID 10883341
[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclohexyl]methanol
CID 140982899
[(1R,2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopentyl]methanol
CID 67782499

Frequently Asked Questions

What is the IUPAC name of [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol?
The IUPAC name of [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol (CID 16655222) is [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol.
What is the SMILES notation for [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol?
The canonical SMILES for [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol is CC(C)(C)[Si](C)(C)OC[C@@]1(C)C[C@@]1(F)CO.
What is the InChIKey of [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol?
The InChIKey is IAEUWMXFMDLYPY-VXGBXAGGSA-N. The full InChI is InChI=1S/C12H25FO2Si/c1-10(2,3)16(5,6)15-9-11(4)7-12(11,13)8-14/h14H,7-9H2,1-6H3/t11-,12-/m1/s1.
What are the key properties of [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol?
[(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol has a molecular weight of 248.41 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-fluoro-2-methylcyclopropyl]methanol is sourced from PubChem (CID 16655222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).