bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane

C16H30OSi — CID 135076235

IUPACbis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane
SMILESC=CC(C)[C@H](O[SiH](C/C=C\C)C/C=C\C)C(C)C
InChIInChI=1S/C16H30OSi/c1-7-10-12-18(13-11-8-2)17-16(14(4)5)15(6)9-3/h7-11,14-16,18H,3,12-13H2,1-2,4-6H3/b10-7-,11-8-/t15?,16-/m1/s1
InChIKeyJGYKYEFXZDVMFS-DRLWUDHLSA-N
MW266.50 g/mol
LogP4.73
Rot. Bonds9

About bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane

bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane (PubChem CID 135076235) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane.

Molecular Properties

Compound Namebis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane
PubChem CID135076235
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Namebis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane
SMILESC=CC(C)[C@H](O[SiH](C/C=C\C)C/C=C\C)C(C)C
InChIInChI=1S/C16H30OSi/c1-7-10-12-18(13-11-8-2)17-16(14(4)5)15(6)9-3/h7-11,14-16,18H,3,12-13H2,1-2,4-6H3/b10-7-,11-8-/t15?,16-/m1/s1
InChIKeyJGYKYEFXZDVMFS-DRLWUDHLSA-N
XLogP4.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.50
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane?
The IUPAC name of bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane (CID 135076235) is bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane.
What is the SMILES notation for bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane?
The canonical SMILES for bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane is C=CC(C)[C@H](O[SiH](C/C=C\C)C/C=C\C)C(C)C.
What is the InChIKey of bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane?
The InChIKey is JGYKYEFXZDVMFS-DRLWUDHLSA-N. The full InChI is InChI=1S/C16H30OSi/c1-7-10-12-18(13-11-8-2)17-16(14(4)5)15(6)9-3/h7-11,14-16,18H,3,12-13H2,1-2,4-6H3/b10-7-,11-8-/t15?,16-/m1/s1.
What are the key properties of bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane?
bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane has a molecular weight of 266.50 g/mol, XLogP of 4.73, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(Z)-but-2-enyl]-[(3R)-2,4-dimethylhex-5-en-3-yl]oxysilane is sourced from PubChem (CID 135076235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).