[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol

C13H28O2Si — CID 11379566

IUPAC[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
SMILESCC(C)C(C)(C)[Si](C)(C)OC[C@H]1C[C@H]1CO
InChIInChI=1S/C13H28O2Si/c1-10(2)13(3,4)16(5,6)15-9-12-7-11(12)8-14/h10-12,14H,7-9H2,1-6H3/t11-,12+/m0/s1
InChIKeySOFPHCGDBMMXOE-NWDGAFQWSA-N
MW244.45 g/mol
LogP3.27
Rot. Bonds6

About [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol

[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol (PubChem CID 11379566) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
PubChem CID11379566
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
SMILESCC(C)C(C)(C)[Si](C)(C)OC[C@H]1C[C@H]1CO
InChIInChI=1S/C13H28O2Si/c1-10(2)13(3,4)16(5,6)15-9-12-7-11(12)8-14/h10-12,14H,7-9H2,1-6H3/t11-,12+/m0/s1
InChIKeySOFPHCGDBMMXOE-NWDGAFQWSA-N
XLogP3.27
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol?
The IUPAC name of [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol (CID 11379566) is [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol.
What is the SMILES notation for [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol?
The canonical SMILES for [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol is CC(C)C(C)(C)[Si](C)(C)OC[C@H]1C[C@H]1CO.
What is the InChIKey of [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol?
The InChIKey is SOFPHCGDBMMXOE-NWDGAFQWSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-10(2)13(3,4)16(5,6)15-9-12-7-11(12)8-14/h10-12,14H,7-9H2,1-6H3/t11-,12+/m0/s1.
What are the key properties of [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol?
[(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol has a molecular weight of 244.45 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S)-2-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol is sourced from PubChem (CID 11379566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).