[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane

C14H26O7Si — CID 173303950

IUPAC[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane
SMILES[SiH3]OC(CCOCC1CO1)(COCC1CO1)COCC1CO1
InChIInChI=1S/C14H26O7Si/c22-21-14(9-16-4-12-7-19-12,10-17-5-13-8-20-13)1-2-15-3-11-6-18-11/h11-13H,1-10H2,22H3
InChIKeyAMLJRKKMEIRFTB-UHFFFAOYSA-N
MW334.44 g/mol
LogP-1.34
Rot. Bonds14

About [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane

[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane (PubChem CID 173303950) has the molecular formula C14H26O7Si and a molecular weight of 334.44 g/mol. Its IUPAC name is [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane.

Molecular Properties

Compound Name[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane
PubChem CID173303950
Molecular FormulaC14H26O7Si
Molecular Weight334.44 g/mol
Exact Mass334.14
IUPAC Name[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane
SMILES[SiH3]OC(CCOCC1CO1)(COCC1CO1)COCC1CO1
InChIInChI=1S/C14H26O7Si/c22-21-14(9-16-4-12-7-19-12,10-17-5-13-8-20-13)1-2-15-3-11-6-18-11/h11-13H,1-10H2,22H3
InChIKeyAMLJRKKMEIRFTB-UHFFFAOYSA-N
XLogP-1.34
TPSA74.51 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.44
LogP ≤ 5-1.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-[[9-(oxiran-2-ylmethoxy)-5,5-bis[4-(oxiran-2-ylmethoxy)butyl]nonoxy]methyl]oxirane
CID 150577624
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
2-(oxiran-2-ylmethoxymethyl)oxirane diazide
CID 175700488
2-[[(E)-4-methylsulfanyl-2,2-bis[2-(oxiran-2-ylmethoxy)ethyl]but-3-enoxy]methyl]oxirane
CID 175622490
2-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxymethyl]oxirane
CID 130476668
2-[4-[4-[4-[4-[4-[4-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxymethyl]oxirane
CID 130476685
2-[18-(oxiran-2-ylmethoxy)octadecoxymethyl]oxirane
CID 172718038
2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
CID 22290133
methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
2-(propoxymethyl)oxirane
CID 18406
2-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[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]ethoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxymethyl]oxirane
CID 91036446
2-methyl-6-(oxiran-2-ylmethoxy)hexan-2-ol;zirconium
CID 87744459

Frequently Asked Questions

What is the IUPAC name of [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane?
The IUPAC name of [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane (CID 173303950) is [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane.
What is the SMILES notation for [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane?
The canonical SMILES for [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane is [SiH3]OC(CCOCC1CO1)(COCC1CO1)COCC1CO1.
What is the InChIKey of [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane?
The InChIKey is AMLJRKKMEIRFTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O7Si/c22-21-14(9-16-4-12-7-19-12,10-17-5-13-8-20-13)1-2-15-3-11-6-18-11/h11-13H,1-10H2,22H3.
What are the key properties of [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane?
[1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane has a molecular weight of 334.44 g/mol, XLogP of -1.34, 14 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1,4-bis(oxiran-2-ylmethoxy)-2-(oxiran-2-ylmethoxymethyl)butan-2-yl]oxysilane is sourced from PubChem (CID 173303950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).