trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane

C36H80O6Si4 — CID 160619243

IUPACtrimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane
SMILESCC1(COCCC[Si](C)(C)C)CO1.C[Si](C)(C)CCC1CO1.C[Si](C)(C)CCCCCC1CO1.C[Si](C)(C)CCCOCC1CO1
InChIInChI=1S/C10H22O2Si.C10H22OSi.C9H20O2Si.C7H16OSi/c1-10(9-12-10)8-11-6-5-7-13(2,3)4;1-12(2,3)8-6-4-5-7-10-9-11-10;1-12(2,3)6-4-5-10-7-9-8-11-9;1-9(2,3)5-4-7-6-8-7/h5-9H2,1-4H3;10H,4-9H2,1-3H3;9H,4-8H2,1-3H3;7H,4-6H2,1-3H3
InChIKeyRGMIYFYZQCVRAU-UHFFFAOYSA-N
MW721.37 g/mol
LogP10.05
Rot. Bonds21

About trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane

trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane (PubChem CID 160619243) has the molecular formula C36H80O6Si4 and a molecular weight of 721.37 g/mol. Its IUPAC name is trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane.

Molecular Properties

Compound Nametrimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane
PubChem CID160619243
Molecular FormulaC36H80O6Si4
Molecular Weight721.37 g/mol
Exact Mass720.50
IUPAC Nametrimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane
SMILESCC1(COCCC[Si](C)(C)C)CO1.C[Si](C)(C)CCC1CO1.C[Si](C)(C)CCCCCC1CO1.C[Si](C)(C)CCCOCC1CO1
InChIInChI=1S/C10H22O2Si.C10H22OSi.C9H20O2Si.C7H16OSi/c1-10(9-12-10)8-11-6-5-7-13(2,3)4;1-12(2,3)8-6-4-5-7-10-9-11-10;1-12(2,3)6-4-5-10-7-9-8-11-9;1-9(2,3)5-4-7-6-8-7/h5-9H2,1-4H3;10H,4-9H2,1-3H3;9H,4-8H2,1-3H3;7H,4-6H2,1-3H3
InChIKeyRGMIYFYZQCVRAU-UHFFFAOYSA-N
XLogP10.05
TPSA68.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms46
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500721.37
LogP ≤ 510.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane?
The IUPAC name of trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane (CID 160619243) is trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane.
What is the SMILES notation for trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane?
The canonical SMILES for trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane is CC1(COCCC[Si](C)(C)C)CO1.C[Si](C)(C)CCC1CO1.C[Si](C)(C)CCCCCC1CO1.C[Si](C)(C)CCCOCC1CO1.
What is the InChIKey of trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane?
The InChIKey is RGMIYFYZQCVRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2Si.C10H22OSi.C9H20O2Si.C7H16OSi/c1-10(9-12-10)8-11-6-5-7-13(2,3)4;1-12(2,3)8-6-4-5-7-10-9-11-10;1-12(2,3)6-4-5-10-7-9-8-11-9;1-9(2,3)5-4-7-6-8-7/h5-9H2,1-4H3;10H,4-9H2,1-3H3;9H,4-8H2,1-3H3;7H,4-6H2,1-3H3.
What are the key properties of trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane?
trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane has a molecular weight of 721.37 g/mol, XLogP of 10.05, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-[(2-methyloxiran-2-yl)methoxy]propyl]silane;trimethyl-[2-(oxiran-2-yl)ethyl]silane;trimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane;trimethyl-[5-(oxiran-2-yl)pentyl]silane is sourced from PubChem (CID 160619243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).