6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol

C13H26O2Si — CID 173134931

IUPAC6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol
SMILESC[SiH](C)OC(C1C2CCC(O)C21)C(C)(C)C
InChIInChI=1S/C13H26O2Si/c1-13(2,3)12(15-16(4)5)11-8-6-7-9(14)10(8)11/h8-12,14,16H,6-7H2,1-5H3
InChIKeyYKKNYDINUMPHIA-UHFFFAOYSA-N
MW242.43 g/mol
LogP2.42
Rot. Bonds3

About 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol

6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol (PubChem CID 173134931) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol.

Molecular Properties

Compound Name6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol
PubChem CID173134931
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol
SMILESC[SiH](C)OC(C1C2CCC(O)C21)C(C)(C)C
InChIInChI=1S/C13H26O2Si/c1-13(2,3)12(15-16(4)5)11-8-6-7-9(14)10(8)11/h8-12,14,16H,6-7H2,1-5H3
InChIKeyYKKNYDINUMPHIA-UHFFFAOYSA-N
XLogP2.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 52.42
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

(3aR,4R,5R,6aS)-4-(1-dimethylsilyloxy-2,2-dimethylpropyl)-5-hydroxy-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
CID 173302315
methyl N-[(1S)-1-[4-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclohexyl]but-3-enyl]carbamate
CID 149433135
3-dimethylsilyloxy-4,4-dimethylpentan-2-one
CID 173030101
2-(1-dimethylsilyloxy-2,2-dimethylpropyl)oxan-4-one
CID 173174133
cis-(1R,2S)-4-tert-butylcyclohexane-1,2-diol
CID 59686945
(1S,5S,6S)-6-(hydroxymethyl)bicyclo[3.1.0]hexan-2-ol
CID 131201890
1-(2-tert-butylcyclohexyl)-1-dimethylsilyloxypropan-2-ol
CID 173272886
(1R,6R)-6-aminobicyclo[3.1.0]hexan-2-ol
CID 83814962
(1S,2R,3R,6R,7R)-tricyclo[5.3.0.02,6]decan-3-ol
CID 39353118
(1S)-1-dimethylsilyloxy-3,3-dimethyl-2-propan-2-ylbutan-1-ol
CID 173123768
[1-[3-(8-chloro-1-iodoimidazo[1,5-a]pyrazin-3-yl)cyclobutyl]-2,2-dimethylpropoxy]-dimethylsilane
CID 154084227
prop-2-enyl (2S)-2-(1-dimethylsilyloxy-2,2-dimethylpropyl)-4-oxopyrrolidine-1-carboxylate
CID 173171481

Frequently Asked Questions

What is the IUPAC name of 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol?
The IUPAC name of 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol (CID 173134931) is 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol.
What is the SMILES notation for 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol?
The canonical SMILES for 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol is C[SiH](C)OC(C1C2CCC(O)C21)C(C)(C)C.
What is the InChIKey of 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol?
The InChIKey is YKKNYDINUMPHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-13(2,3)12(15-16(4)5)11-8-6-7-9(14)10(8)11/h8-12,14,16H,6-7H2,1-5H3.
What are the key properties of 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol?
6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol has a molecular weight of 242.43 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol is sourced from PubChem (CID 173134931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).