[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane

C15H26O4Si — CID 123742519

IUPAC[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane
SMILES[SiH3]C1CC2CC1C(COCC1CO1)C2COCC1CO1
InChIInChI=1S/C15H26O4Si/c20-15-2-9-1-12(15)14(8-17-4-11-6-19-11)13(9)7-16-3-10-5-18-10/h9-15H,1-8H2,20H3
InChIKeyBHEZLDOFOAJTNW-UHFFFAOYSA-N
MW298.45 g/mol
LogP0.24
Rot. Bonds8

About [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane

[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane (PubChem CID 123742519) has the molecular formula C15H26O4Si and a molecular weight of 298.45 g/mol. Its IUPAC name is [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane.

Molecular Properties

Compound Name[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane
PubChem CID123742519
Molecular FormulaC15H26O4Si
Molecular Weight298.45 g/mol
Exact Mass298.16
IUPAC Name[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane
SMILES[SiH3]C1CC2CC1C(COCC1CO1)C2COCC1CO1
InChIInChI=1S/C15H26O4Si/c20-15-2-9-1-12(15)14(8-17-4-11-6-19-11)13(9)7-16-3-10-5-18-10/h9-15H,1-8H2,20H3
InChIKeyBHEZLDOFOAJTNW-UHFFFAOYSA-N
XLogP0.24
TPSA43.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.45
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
CID 22290133
2-methylprop-1-ene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87296159
2-(oxiran-2-ylmethoxymethyl)oxirane diazide
CID 175700488
2-(oxiran-2-ylmethoxymethyl)oxirane;sulfur trioxide
CID 87769776
ethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87071861
(2R)-2-[[4-(oxiran-2-ylmethoxymethyl)cyclohexyl]methoxymethyl]oxirane
CID 88922210
2-(oxiran-2-ylmethoxymethyl)oxirane;thiirene
CID 88761424
4-(oxiran-2-ylmethoxymethyl)-10-oxapentacyclo[6.3.1.13,6.02,7.09,11]tridecane
CID 22957073
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 58765936
ethane-1,2-diol;ethene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 173313374
cyclopentane;ethane-1,2-diol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 88518341

Frequently Asked Questions

What is the IUPAC name of [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane?
The IUPAC name of [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane (CID 123742519) is [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane.
What is the SMILES notation for [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane?
The canonical SMILES for [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane is [SiH3]C1CC2CC1C(COCC1CO1)C2COCC1CO1.
What is the InChIKey of [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane?
The InChIKey is BHEZLDOFOAJTNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O4Si/c20-15-2-9-1-12(15)14(8-17-4-11-6-19-11)13(9)7-16-3-10-5-18-10/h9-15H,1-8H2,20H3.
What are the key properties of [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane?
[5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane has a molecular weight of 298.45 g/mol, XLogP of 0.24, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-bis(oxiran-2-ylmethoxymethyl)-2-bicyclo[2.2.1]heptanyl]silane is sourced from PubChem (CID 123742519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).