(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol

C12H26OSi — CID 15090182

IUPAC(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol
SMILESCC(C)(C/C=C/C[Si](C)(C)C)CCO
InChIInChI=1S/C12H26OSi/c1-12(2,9-10-13)8-6-7-11-14(3,4)5/h6-7,13H,8-11H2,1-5H3/b7-6+
InChIKeyREEPRFAOCKMAPC-VOTSOKGWSA-N
MW214.42 g/mol
LogP3.68
Rot. Bonds6

About (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol

(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol (PubChem CID 15090182) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol.

Molecular Properties

Compound Name(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol
PubChem CID15090182
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol
SMILESCC(C)(C/C=C/C[Si](C)(C)C)CCO
InChIInChI=1S/C12H26OSi/c1-12(2,9-10-13)8-6-7-11-14(3,4)5/h6-7,13H,8-11H2,1-5H3/b7-6+
InChIKeyREEPRFAOCKMAPC-VOTSOKGWSA-N
XLogP3.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 53.68
H-Bond Donors ≤ 51
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 (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol?
The IUPAC name of (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol (CID 15090182) is (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol.
What is the SMILES notation for (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol?
The canonical SMILES for (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol is CC(C)(C/C=C/C[Si](C)(C)C)CCO.
What is the InChIKey of (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol?
The InChIKey is REEPRFAOCKMAPC-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H26OSi/c1-12(2,9-10-13)8-6-7-11-14(3,4)5/h6-7,13H,8-11H2,1-5H3/b7-6+.
What are the key properties of (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol?
(E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol has a molecular weight of 214.42 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3,3-dimethyl-7-trimethylsilylhept-5-en-1-ol is sourced from PubChem (CID 15090182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).