methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane

C13H24O7Si — CID 123621626

IUPACmethoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane
SMILESCO[SiH2]CCC(OCC1CO1)(OCC1CO1)OCC1CO1
InChIInChI=1S/C13H24O7Si/c1-14-21-3-2-13(18-7-10-4-15-10,19-8-11-5-16-11)20-9-12-6-17-12/h10-12H,2-9,21H2,1H3
InChIKeyRJQQISJPVOWWSS-UHFFFAOYSA-N
MW320.41 g/mol
LogP-0.57
Rot. Bonds13

About methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane

methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 123621626) has the molecular formula C13H24O7Si and a molecular weight of 320.41 g/mol. Its IUPAC name is methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Namemethoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane
PubChem CID123621626
Molecular FormulaC13H24O7Si
Molecular Weight320.41 g/mol
Exact Mass320.13
IUPAC Namemethoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane
SMILESCO[SiH2]CCC(OCC1CO1)(OCC1CO1)OCC1CO1
InChIInChI=1S/C13H24O7Si/c1-14-21-3-2-13(18-7-10-4-15-10,19-8-11-5-16-11)20-9-12-6-17-12/h10-12H,2-9,21H2,1H3
InChIKeyRJQQISJPVOWWSS-UHFFFAOYSA-N
XLogP-0.57
TPSA74.51 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 5-0.57
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': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-(1,1-dimethoxypropoxymethyl)oxirane
CID 174508703
methoxy-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 123692980
methoxy-[4-(oxiran-2-ylmethoxy)butyl]silane
CID 173377892
methoxy-[3-[2-(oxiran-2-ylmethoxy)ethoxy]propyl]silane
CID 151041352
2-[[2,4-dimethyl-4-(oxiran-2-ylmethoxy)pentan-2-yl]oxymethyl]oxirane
CID 89152762
dimethoxysilane;2-(methoxymethyl)oxirane
CID 175354723
dimethoxymethane;bis(2-(methoxymethyl)oxirane)
CID 159900039
2-(hydroxymethyl)-2-(oxiran-2-ylmethoxy)butane-1,4-diol
CID 87482678
2-(3-methylnonan-3-yloxymethyl)oxirane
CID 154930049
1,1-bis(oxiran-2-ylmethoxy)butane-1,2,2,3,3-pentamine
CID 56622855
[dimethoxy(oxiran-2-ylmethoxy)methyl]-diethoxysilane
CID 175008743
2-(1,1,2-trifluoropropoxymethyl)oxirane
CID 87368360

Frequently Asked Questions

What is the IUPAC name of methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane (CID 123621626) is methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane is CO[SiH2]CCC(OCC1CO1)(OCC1CO1)OCC1CO1.
What is the InChIKey of methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is RJQQISJPVOWWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O7Si/c1-14-21-3-2-13(18-7-10-4-15-10,19-8-11-5-16-11)20-9-12-6-17-12/h10-12H,2-9,21H2,1H3.
What are the key properties of methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane?
methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 320.41 g/mol, XLogP of -0.57, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 123621626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).