[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol

C20H42O3Si2 — CID 173298595

IUPAC[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol
SMILESC[SiH](C)OC(C1C=C(CO)CC1C(O[SiH](C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H42O3Si2/c1-19(2,3)17(22-24(7)8)15-11-14(13-21)12-16(15)18(20(4,5)6)23-25(9)10/h11,15-18,21,24-25H,12-13H2,1-10H3
InChIKeyCVHPJIZCEVZFRQ-UHFFFAOYSA-N
MW386.73 g/mol
LogP4.37
Rot. Bonds7

About [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol

[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol (PubChem CID 173298595) has the molecular formula C20H42O3Si2 and a molecular weight of 386.73 g/mol. Its IUPAC name is [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol.

Molecular Properties

Compound Name[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol
PubChem CID173298595
Molecular FormulaC20H42O3Si2
Molecular Weight386.73 g/mol
Exact Mass386.27
IUPAC Name[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol
SMILESC[SiH](C)OC(C1C=C(CO)CC1C(O[SiH](C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H42O3Si2/c1-19(2,3)17(22-24(7)8)15-11-14(13-21)12-16(15)18(20(4,5)6)23-25(9)10/h11,15-18,21,24-25H,12-13H2,1-10H3
InChIKeyCVHPJIZCEVZFRQ-UHFFFAOYSA-N
XLogP4.37
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.73
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol?
The IUPAC name of [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol (CID 173298595) is [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol.
What is the SMILES notation for [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol?
The canonical SMILES for [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol is C[SiH](C)OC(C1C=C(CO)CC1C(O[SiH](C)C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol?
The InChIKey is CVHPJIZCEVZFRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O3Si2/c1-19(2,3)17(22-24(7)8)15-11-14(13-21)12-16(15)18(20(4,5)6)23-25(9)10/h11,15-18,21,24-25H,12-13H2,1-10H3.
What are the key properties of [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol?
[3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol has a molecular weight of 386.73 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-bis(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclopenten-1-yl]methanol is sourced from PubChem (CID 173298595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).