(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane

C13H24O2Si — CID 173372067

IUPAC(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane
SMILESCCC1(C2CCCCC2)OCCC(=C[SiH3])O1
InChIInChI=1S/C13H24O2Si/c1-2-13(11-6-4-3-5-7-11)14-9-8-12(10-16)15-13/h10-11H,2-9H2,1,16H3
InChIKeyOLCAVGJKEKIOST-UHFFFAOYSA-N
MW240.42 g/mol
LogP2.32
Rot. Bonds2

About (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane

(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane (PubChem CID 173372067) has the molecular formula C13H24O2Si and a molecular weight of 240.42 g/mol. Its IUPAC name is (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane.

Molecular Properties

Compound Name(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane
PubChem CID173372067
Molecular FormulaC13H24O2Si
Molecular Weight240.42 g/mol
Exact Mass240.15
IUPAC Name(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane
SMILESCCC1(C2CCCCC2)OCCC(=C[SiH3])O1
InChIInChI=1S/C13H24O2Si/c1-2-13(11-6-4-3-5-7-11)14-9-8-12(10-16)15-13/h10-11H,2-9H2,1,16H3
InChIKeyOLCAVGJKEKIOST-UHFFFAOYSA-N
XLogP2.32
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane?
The IUPAC name of (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane (CID 173372067) is (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane.
What is the SMILES notation for (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane?
The canonical SMILES for (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane is CCC1(C2CCCCC2)OCCC(=C[SiH3])O1.
What is the InChIKey of (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane?
The InChIKey is OLCAVGJKEKIOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-2-13(11-6-4-3-5-7-11)14-9-8-12(10-16)15-13/h10-11H,2-9H2,1,16H3.
What are the key properties of (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane?
(2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane has a molecular weight of 240.42 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-2-ethyl-1,3-dioxan-4-ylidene)methylsilane is sourced from PubChem (CID 173372067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).