(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol

C18H40OSi2 — CID 15750623

IUPAC(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol
SMILESCC(C)C(O)/C=C(\[Si](C)(C)C)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H40OSi2/c1-13(2)17(19)12-18(20(9,10)11)21(14(3)4,15(5)6)16(7)8/h12-17,19H,1-11H3/b18-12+
InChIKeyGMHIPDGQJBWMLC-LDADJPATSA-N
MW328.69 g/mol
LogP6.03
Rot. Bonds7

About (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol

(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol (PubChem CID 15750623) has the molecular formula C18H40OSi2 and a molecular weight of 328.69 g/mol. Its IUPAC name is (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol.

Molecular Properties

Compound Name(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol
PubChem CID15750623
Molecular FormulaC18H40OSi2
Molecular Weight328.69 g/mol
Exact Mass328.26
IUPAC Name(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol
SMILESCC(C)C(O)/C=C(\[Si](C)(C)C)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H40OSi2/c1-13(2)17(19)12-18(20(9,10)11)21(14(3)4,15(5)6)16(7)8/h12-17,19H,1-11H3/b18-12+
InChIKeyGMHIPDGQJBWMLC-LDADJPATSA-N
XLogP6.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.69
LogP ≤ 56.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol?
The IUPAC name of (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol (CID 15750623) is (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol.
What is the SMILES notation for (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol?
The canonical SMILES for (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol is CC(C)C(O)/C=C(\[Si](C)(C)C)[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol?
The InChIKey is GMHIPDGQJBWMLC-LDADJPATSA-N. The full InChI is InChI=1S/C18H40OSi2/c1-13(2)17(19)12-18(20(9,10)11)21(14(3)4,15(5)6)16(7)8/h12-17,19H,1-11H3/b18-12+.
What are the key properties of (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol?
(E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol has a molecular weight of 328.69 g/mol, XLogP of 6.03, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methyl-1-trimethylsilyl-1-tri(propan-2-yl)silylpent-1-en-3-ol is sourced from PubChem (CID 15750623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).