4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane

C12H22OSi — CID 59227504

IUPAC4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane
SMILESC=C(C)C#CCO[SiH](C(C)C)C(C)C
InChIInChI=1S/C12H22OSi/c1-10(2)8-7-9-13-14(11(3)4)12(5)6/h11-12,14H,1,9H2,2-6H3
InChIKeyPXIFWJPAOJFSKW-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.13
Rot. Bonds4

About 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane

4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane (PubChem CID 59227504) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane
PubChem CID59227504
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane
SMILESC=C(C)C#CCO[SiH](C(C)C)C(C)C
InChIInChI=1S/C12H22OSi/c1-10(2)8-7-9-13-14(11(3)4)12(5)6/h11-12,14H,1,9H2,2-6H3
InChIKeyPXIFWJPAOJFSKW-UHFFFAOYSA-N
XLogP3.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane?
The IUPAC name of 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane (CID 59227504) is 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane.
What is the SMILES notation for 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane?
The canonical SMILES for 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane is C=C(C)C#CCO[SiH](C(C)C)C(C)C.
What is the InChIKey of 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane?
The InChIKey is PXIFWJPAOJFSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-10(2)8-7-9-13-14(11(3)4)12(5)6/h11-12,14H,1,9H2,2-6H3.
What are the key properties of 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane?
4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane has a molecular weight of 210.39 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpent-4-en-2-ynoxy-di(propan-2-yl)silane is sourced from PubChem (CID 59227504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).