1,1,5-trimethyl-2-methylidenesilinan-4-ol

C9H18OSi — CID 85294944

IUPAC1,1,5-trimethyl-2-methylidenesilinan-4-ol
SMILESC=C1CC(O)C(C)C[Si]1(C)C
InChIInChI=1S/C9H18OSi/c1-7-6-11(3,4)8(2)5-9(7)10/h7,9-10H,2,5-6H2,1,3-4H3
InChIKeyWRZJOECLJXWTSZ-UHFFFAOYSA-N
MW170.33 g/mol
LogP2.19
Rot. Bonds

About 1,1,5-trimethyl-2-methylidenesilinan-4-ol

1,1,5-trimethyl-2-methylidenesilinan-4-ol (PubChem CID 85294944) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is 1,1,5-trimethyl-2-methylidenesilinan-4-ol.

Molecular Properties

Compound Name1,1,5-trimethyl-2-methylidenesilinan-4-ol
PubChem CID85294944
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name1,1,5-trimethyl-2-methylidenesilinan-4-ol
SMILESC=C1CC(O)C(C)C[Si]1(C)C
InChIInChI=1S/C9H18OSi/c1-7-6-11(3,4)8(2)5-9(7)10/h7,9-10H,2,5-6H2,1,3-4H3
InChIKeyWRZJOECLJXWTSZ-UHFFFAOYSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.19
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 1,1,5-trimethyl-2-methylidenesilinan-4-ol?
The IUPAC name of 1,1,5-trimethyl-2-methylidenesilinan-4-ol (CID 85294944) is 1,1,5-trimethyl-2-methylidenesilinan-4-ol.
What is the SMILES notation for 1,1,5-trimethyl-2-methylidenesilinan-4-ol?
The canonical SMILES for 1,1,5-trimethyl-2-methylidenesilinan-4-ol is C=C1CC(O)C(C)C[Si]1(C)C.
What is the InChIKey of 1,1,5-trimethyl-2-methylidenesilinan-4-ol?
The InChIKey is WRZJOECLJXWTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-7-6-11(3,4)8(2)5-9(7)10/h7,9-10H,2,5-6H2,1,3-4H3.
What are the key properties of 1,1,5-trimethyl-2-methylidenesilinan-4-ol?
1,1,5-trimethyl-2-methylidenesilinan-4-ol has a molecular weight of 170.33 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,5-trimethyl-2-methylidenesilinan-4-ol is sourced from PubChem (CID 85294944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).