2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane

C13H26O4Si — CID 175335046

IUPAC2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane
SMILESC(OCC1CO1)C1CO1.CCC[SiH]1CCCCO1
InChIInChI=1S/C7H16OSi.C6H10O3/c1-2-6-9-7-4-3-5-8-9;1(5-3-8-5)7-2-6-4-9-6/h9H,2-7H2,1H3;5-6H,1-4H2
InChIKeyBULNEBCTSCOPJU-UHFFFAOYSA-N
MW274.43 g/mol
LogP1.73
Rot. Bonds6

About 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane

2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane (PubChem CID 175335046) has the molecular formula C13H26O4Si and a molecular weight of 274.43 g/mol. Its IUPAC name is 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane.

Molecular Properties

Compound Name2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane
PubChem CID175335046
Molecular FormulaC13H26O4Si
Molecular Weight274.43 g/mol
Exact Mass274.16
IUPAC Name2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane
SMILESC(OCC1CO1)C1CO1.CCC[SiH]1CCCCO1
InChIInChI=1S/C7H16OSi.C6H10O3/c1-2-6-9-7-4-3-5-8-9;1(5-3-8-5)7-2-6-4-9-6/h9H,2-7H2,1H3;5-6H,1-4H2
InChIKeyBULNEBCTSCOPJU-UHFFFAOYSA-N
XLogP1.73
TPSA43.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 51.73
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

N-methylmethanamine;propan-1-amine;2-propyloxasilinane
CID 173299792
1,2,2,6,6-pentamethylpiperidine;2-propyloxasilinane
CID 174686072
2-(oxiran-2-ylmethoxymethyl)oxirane;tetradecane
CID 87058991
2-(oxiran-2-ylmethoxymethyl)oxirane;propan-1-ol
CID 22222974
ethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87071861
methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
2-(propoxymethyl)oxirane
CID 18406
2-(pentoxymethyl)oxirane
CID 160890113
2-butyloxirane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 130365137
2-(butoxymethyl)oxirane;oxonane
CID 20569142
(2S)-2-(octoxymethyl)oxirane
CID 87274801
2-(octoxymethyl)oxirane;2-(tetradecoxymethyl)oxirane
CID 174518537

Frequently Asked Questions

What is the IUPAC name of 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane?
The IUPAC name of 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane (CID 175335046) is 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane.
What is the SMILES notation for 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane?
The canonical SMILES for 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane is C(OCC1CO1)C1CO1.CCC[SiH]1CCCCO1.
What is the InChIKey of 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane?
The InChIKey is BULNEBCTSCOPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16OSi.C6H10O3/c1-2-6-9-7-4-3-5-8-9;1(5-3-8-5)7-2-6-4-9-6/h9H,2-7H2,1H3;5-6H,1-4H2.
What are the key properties of 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane?
2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane has a molecular weight of 274.43 g/mol, XLogP of 1.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxiran-2-ylmethoxymethyl)oxirane;2-propyloxasilinane is sourced from PubChem (CID 175335046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).