(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol

C9H18OSi — CID 14742100

IUPAC(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol
SMILESCC(O)/C=C\C=C\[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-9(10)7-5-6-8-11(2,3)4/h5-10H,1-4H3/b7-5-,8-6+
InChIKeyPWBWGNFVNRBXKD-CGXWXWIYSA-N
MW170.33 g/mol
LogP2.36
Rot. Bonds3

About (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol

(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol (PubChem CID 14742100) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol.

Molecular Properties

Compound Name(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol
PubChem CID14742100
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol
SMILESCC(O)/C=C\C=C\[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-9(10)7-5-6-8-11(2,3)4/h5-10H,1-4H3/b7-5-,8-6+
InChIKeyPWBWGNFVNRBXKD-CGXWXWIYSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol?
The IUPAC name of (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol (CID 14742100) is (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol.
What is the SMILES notation for (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol?
The canonical SMILES for (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol is CC(O)/C=C\C=C\[Si](C)(C)C.
What is the InChIKey of (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol?
The InChIKey is PWBWGNFVNRBXKD-CGXWXWIYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-9(10)7-5-6-8-11(2,3)4/h5-10H,1-4H3/b7-5-,8-6+.
What are the key properties of (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol?
(3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol has a molecular weight of 170.33 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5E)-6-trimethylsilylhexa-3,5-dien-2-ol is sourced from PubChem (CID 14742100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).