(2-benzyloxan-2-yl)silane

C12H18OSi — CID 123186626

IUPAC(2-benzyloxan-2-yl)silane
SMILES[SiH3]C1(Cc2ccccc2)CCCCO1
InChIInChI=1S/C12H18OSi/c14-12(8-4-5-9-13-12)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,14H3
InChIKeyFURVVDFQXSZEQR-UHFFFAOYSA-N
MW206.36 g/mol
LogP1.49
Rot. Bonds2

About (2-benzyloxan-2-yl)silane

(2-benzyloxan-2-yl)silane (PubChem CID 123186626) has the molecular formula C12H18OSi and a molecular weight of 206.36 g/mol. Its IUPAC name is (2-benzyloxan-2-yl)silane.

Molecular Properties

Compound Name(2-benzyloxan-2-yl)silane
PubChem CID123186626
Molecular FormulaC12H18OSi
Molecular Weight206.36 g/mol
Exact Mass206.11
IUPAC Name(2-benzyloxan-2-yl)silane
SMILES[SiH3]C1(Cc2ccccc2)CCCCO1
InChIInChI=1S/C12H18OSi/c14-12(8-4-5-9-13-12)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,14H3
InChIKeyFURVVDFQXSZEQR-UHFFFAOYSA-N
XLogP1.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 51.49
H-Bond Donors ≤ 50
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 (2-benzyloxan-2-yl)silane?
The IUPAC name of (2-benzyloxan-2-yl)silane (CID 123186626) is (2-benzyloxan-2-yl)silane.
What is the SMILES notation for (2-benzyloxan-2-yl)silane?
The canonical SMILES for (2-benzyloxan-2-yl)silane is [SiH3]C1(Cc2ccccc2)CCCCO1.
What is the InChIKey of (2-benzyloxan-2-yl)silane?
The InChIKey is FURVVDFQXSZEQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18OSi/c14-12(8-4-5-9-13-12)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,14H3.
What are the key properties of (2-benzyloxan-2-yl)silane?
(2-benzyloxan-2-yl)silane has a molecular weight of 206.36 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzyloxan-2-yl)silane is sourced from PubChem (CID 123186626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).