(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol

C17H36O2Si — CID 53328468

IUPAC(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol
SMILESC=C[C@H](C)CC(O)C[C@@H](CCC)O[Si](CC)(CC)CC
InChIInChI=1S/C17H36O2Si/c1-7-12-17(14-16(18)13-15(6)8-2)19-20(9-3,10-4)11-5/h8,15-18H,2,7,9-14H2,1,3-6H3/t15-,16?,17+/m0/s1
InChIKeyPJVLCKJCGSJVCW-RPCGPGEBSA-N
MW300.56 g/mol
LogP5.14
Rot. Bonds12

About (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol

(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol (PubChem CID 53328468) has the molecular formula C17H36O2Si and a molecular weight of 300.56 g/mol. Its IUPAC name is (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol.

Molecular Properties

Compound Name(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol
PubChem CID53328468
Molecular FormulaC17H36O2Si
Molecular Weight300.56 g/mol
Exact Mass300.25
IUPAC Name(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol
SMILESC=C[C@H](C)CC(O)C[C@@H](CCC)O[Si](CC)(CC)CC
InChIInChI=1S/C17H36O2Si/c1-7-12-17(14-16(18)13-15(6)8-2)19-20(9-3,10-4)11-5/h8,15-18H,2,7,9-14H2,1,3-6H3/t15-,16?,17+/m0/s1
InChIKeyPJVLCKJCGSJVCW-RPCGPGEBSA-N
XLogP5.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.56
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3R,5S)-3-methyldec-1-en-5-ol
CID 135060658
(4R,6R)-2,6-dimethyloct-7-en-4-ol
CID 92953759
(2R,4S)-1-phenyl-4-triethylsilyloxyhept-6-en-2-ol
CID 122388230
(E,2R,3R,6R)-2,4,6-trimethyl-3-triethylsilyloxynon-4-en-1-ol
CID 101227709
carbonic acid;3-methylhex-1-ene
CID 161181273
(2S,3R)-2-methyl-3-triethylsilyloxyhexan-1-ol
CID 57278270
[(4R,6R)-6-methyloct-7-en-4-yl] (2E,4Z)-2-fluorohepta-2,4,6-trienimidate
CID 146414995
4-ethenoxyheptane
CID 59883029
3,5,6-trimethyloct-1-ene
CID 90839581
butane;3,6-dimethylocta-1,7-diene;ethane;propane
CID 144723339
(3S,5R,7S,9S,11S)-9-[tert-butyl(dimethyl)silyl]oxy-1,13-bis(phenylmethoxy)-3,11-bis(triethylsilyloxy)tridecane-5,7-diol
CID 102445359
[(E,5R)-2-bromodec-2-en-5-yl]oxy-triethylsilane
CID 10861041

Frequently Asked Questions

What is the IUPAC name of (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol?
The IUPAC name of (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol (CID 53328468) is (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol.
What is the SMILES notation for (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol?
The canonical SMILES for (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol is C=C[C@H](C)CC(O)C[C@@H](CCC)O[Si](CC)(CC)CC.
What is the InChIKey of (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol?
The InChIKey is PJVLCKJCGSJVCW-RPCGPGEBSA-N. The full InChI is InChI=1S/C17H36O2Si/c1-7-12-17(14-16(18)13-15(6)8-2)19-20(9-3,10-4)11-5/h8,15-18H,2,7,9-14H2,1,3-6H3/t15-,16?,17+/m0/s1.
What are the key properties of (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol?
(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol has a molecular weight of 300.56 g/mol, XLogP of 5.14, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol is sourced from PubChem (CID 53328468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).