(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol

C14H26OSi — CID 14176571

IUPAC(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol
SMILESC=C/C=C/CCC/C=C(/CO)C[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-6-7-8-9-10-11-14(12-15)13-16(2,3)4/h5-7,11,15H,1,8-10,12-13H2,2-4H3/b7-6+,14-11-
InChIKeyYYXVRLSEJMLGLQ-SAVKCZEGSA-N
MW238.45 g/mol
LogP4.16
Rot. Bonds8

About (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol

(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol (PubChem CID 14176571) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol.

Molecular Properties

Compound Name(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol
PubChem CID14176571
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol
SMILESC=C/C=C/CCC/C=C(/CO)C[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-6-7-8-9-10-11-14(12-15)13-16(2,3)4/h5-7,11,15H,1,8-10,12-13H2,2-4H3/b7-6+,14-11-
InChIKeyYYXVRLSEJMLGLQ-SAVKCZEGSA-N
XLogP4.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol?
The IUPAC name of (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol (CID 14176571) is (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol.
What is the SMILES notation for (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol?
The canonical SMILES for (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol is C=C/C=C/CCC/C=C(/CO)C[Si](C)(C)C.
What is the InChIKey of (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol?
The InChIKey is YYXVRLSEJMLGLQ-SAVKCZEGSA-N. The full InChI is InChI=1S/C14H26OSi/c1-5-6-7-8-9-10-11-14(12-15)13-16(2,3)4/h5-7,11,15H,1,8-10,12-13H2,2-4H3/b7-6+,14-11-.
What are the key properties of (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol?
(2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol has a molecular weight of 238.45 g/mol, XLogP of 4.16, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,7E)-2-(trimethylsilylmethyl)deca-2,7,9-trien-1-ol is sourced from PubChem (CID 14176571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).