dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane

C18H42O3Si2 — CID 175268067

IUPACdodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane
SMILESCCCCCCC=CCC(O)CCO.C[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C12H24O2.C6H18OSi2/c1-2-3-4-5-6-7-8-9-12(14)10-11-13;1-8(2,3)7-9(4,5)6/h7-8,12-14H,2-6,9-11H2,1H3;1-6H3
InChIKeyDEVMDMWJHRVUBD-UHFFFAOYSA-N
MW362.70 g/mol
LogP5.32
Rot. Bonds11

About dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane

dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane (PubChem CID 175268067) has the molecular formula C18H42O3Si2 and a molecular weight of 362.70 g/mol. Its IUPAC name is dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane.

Molecular Properties

Compound Namedodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane
PubChem CID175268067
Molecular FormulaC18H42O3Si2
Molecular Weight362.70 g/mol
Exact Mass362.27
IUPAC Namedodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane
SMILESCCCCCCC=CCC(O)CCO.C[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C12H24O2.C6H18OSi2/c1-2-3-4-5-6-7-8-9-12(14)10-11-13;1-8(2,3)7-9(4,5)6/h7-8,12-14H,2-6,9-11H2,1H3;1-6H3
InChIKeyDEVMDMWJHRVUBD-UHFFFAOYSA-N
XLogP5.32
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.70
LogP ≤ 55.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

(E)-heptadec-7-en-5-ol
CID 122442571
(Z)-octadec-10-en-8-ol
CID 173051806
(Z)-pentadec-8-en-6-ol
CID 10398809
(E,10S)-henicos-7-en-10-ol
CID 14607531
(E)-hexadec-7-ene-1,3-diol
CID 134326669
(Z)-dodec-6-ene-1,3-diol
CID 10488272
(Z)-tridec-8-en-6-ol
CID 170849340
(E)-dec-4-ene-1,2-diol
CID 13288576
3-methyltetradec-5-en-1-ol
CID 141478890
(E)-12-hydroxyoctadec-9-enal
CID 87273358
(2R,4R)-nonadec-6-ene-1,2,4-triol
CID 162937145
(E,2S,4R)-nonadec-6-ene-1,2,4-triol
CID 56590714

Frequently Asked Questions

What is the IUPAC name of dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane?
The IUPAC name of dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane (CID 175268067) is dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane.
What is the SMILES notation for dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane?
The canonical SMILES for dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane is CCCCCCC=CCC(O)CCO.C[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane?
The InChIKey is DEVMDMWJHRVUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2.C6H18OSi2/c1-2-3-4-5-6-7-8-9-12(14)10-11-13;1-8(2,3)7-9(4,5)6/h7-8,12-14H,2-6,9-11H2,1H3;1-6H3.
What are the key properties of dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane?
dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane has a molecular weight of 362.70 g/mol, XLogP of 5.32, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dodec-5-ene-1,3-diol;trimethyl(trimethylsilyloxy)silane is sourced from PubChem (CID 175268067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).