(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol

C15H30OSi — CID 134965043

IUPAC(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol
SMILESC/C=C/C(O)/C=C/[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-8-9-15(16)10-11-17(12(2)3,13(4)5)14(6)7/h8-16H,1-7H3/b9-8+,11-10+
InChIKeyXYBMOTSQQPGVLM-BNFZFUHLSA-N
MW254.49 g/mol
LogP4.70
Rot. Bonds6

About (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol

(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol (PubChem CID 134965043) has the molecular formula C15H30OSi and a molecular weight of 254.49 g/mol. Its IUPAC name is (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol.

Molecular Properties

Compound Name(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol
PubChem CID134965043
Molecular FormulaC15H30OSi
Molecular Weight254.49 g/mol
Exact Mass254.21
IUPAC Name(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol
SMILESC/C=C/C(O)/C=C/[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-8-9-15(16)10-11-17(12(2)3,13(4)5)14(6)7/h8-16H,1-7H3/b9-8+,11-10+
InChIKeyXYBMOTSQQPGVLM-BNFZFUHLSA-N
XLogP4.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.49
LogP ≤ 54.70
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'}

Analyze (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol?
The IUPAC name of (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol (CID 134965043) is (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol.
What is the SMILES notation for (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol?
The canonical SMILES for (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol is C/C=C/C(O)/C=C/[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol?
The InChIKey is XYBMOTSQQPGVLM-BNFZFUHLSA-N. The full InChI is InChI=1S/C15H30OSi/c1-8-9-15(16)10-11-17(12(2)3,13(4)5)14(6)7/h8-16H,1-7H3/b9-8+,11-10+.
What are the key properties of (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol?
(1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol has a molecular weight of 254.49 g/mol, XLogP of 4.70, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,4E)-1-tri(propan-2-yl)silylhexa-1,4-dien-3-ol is sourced from PubChem (CID 134965043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).