(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol

C26H54O2Si — CID 174214951

IUPAC(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol
SMILESC[SiH](C)OC(CCCCCCCCCC/C=C\CCCCCCCO)C(C)(C)C
InChIInChI=1S/C26H54O2Si/c1-26(2,3)25(28-29(4)5)23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-27/h8,10,25,27,29H,6-7,9,11-24H2,1-5H3/b10-8-
InChIKeyRVHVALHEVPMEIK-NTMALXAHSA-N
MW426.80 g/mol
LogP8.19
Rot. Bonds20

About (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol

(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol (PubChem CID 174214951) has the molecular formula C26H54O2Si and a molecular weight of 426.80 g/mol. Its IUPAC name is (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol.

Molecular Properties

Compound Name(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol
PubChem CID174214951
Molecular FormulaC26H54O2Si
Molecular Weight426.80 g/mol
Exact Mass426.39
IUPAC Name(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol
SMILESC[SiH](C)OC(CCCCCCCCCC/C=C\CCCCCCCO)C(C)(C)C
InChIInChI=1S/C26H54O2Si/c1-26(2,3)25(28-29(4)5)23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-27/h8,10,25,27,29H,6-7,9,11-24H2,1-5H3/b10-8-
InChIKeyRVHVALHEVPMEIK-NTMALXAHSA-N
XLogP8.19
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.80
LogP ≤ 58.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol?
The IUPAC name of (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol (CID 174214951) is (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol.
What is the SMILES notation for (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol?
The canonical SMILES for (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol is C[SiH](C)OC(CCCCCCCCCC/C=C\CCCCCCCO)C(C)(C)C.
What is the InChIKey of (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol?
The InChIKey is RVHVALHEVPMEIK-NTMALXAHSA-N. The full InChI is InChI=1S/C26H54O2Si/c1-26(2,3)25(28-29(4)5)23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-27/h8,10,25,27,29H,6-7,9,11-24H2,1-5H3/b10-8-.
What are the key properties of (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol?
(Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol has a molecular weight of 426.80 g/mol, XLogP of 8.19, 20 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-20-dimethylsilyloxy-21,21-dimethyldocos-8-en-1-ol is sourced from PubChem (CID 174214951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).