3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane

C15H32O7Si — CID 175337503

IUPAC3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane
SMILESCOC(CC[Si](OC)(OC)OC(C)CCCOCC1CO1)OC
InChIInChI=1S/C15H32O7Si/c1-13(7-6-9-20-11-14-12-21-14)22-23(18-4,19-5)10-8-15(16-2)17-3/h13-15H,6-12H2,1-5H3
InChIKeyDXXHMYIMAYEZAB-UHFFFAOYSA-N
MW352.50 g/mol
LogP1.83
Rot. Bonds15

About 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane

3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane (PubChem CID 175337503) has the molecular formula C15H32O7Si and a molecular weight of 352.50 g/mol. Its IUPAC name is 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane.

Molecular Properties

Compound Name3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane
PubChem CID175337503
Molecular FormulaC15H32O7Si
Molecular Weight352.50 g/mol
Exact Mass352.19
IUPAC Name3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane
SMILESCOC(CC[Si](OC)(OC)OC(C)CCCOCC1CO1)OC
InChIInChI=1S/C15H32O7Si/c1-13(7-6-9-20-11-14-12-21-14)22-23(18-4,19-5)10-8-15(16-2)17-3/h13-15H,6-12H2,1-5H3
InChIKeyDXXHMYIMAYEZAB-UHFFFAOYSA-N
XLogP1.83
TPSA67.91 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds15
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.50
LogP ≤ 51.83
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

trimethoxy-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 10130712
oxiran-2-ylmethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 159211950
dimethoxy-(2-methylpropoxy)-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 169273482
ethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 161088311
5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane
CID 173147325
methyl-[3-[[(2R)-oxiran-2-yl]methoxy]propyl]-di(propan-2-yloxy)silane
CID 150003668
[4-[dimethoxy-[3-(2-methylprop-2-enoyloxy)propyl]silyl]oxy-7-(oxiran-2-ylmethoxy)heptyl] 2-methylprop-2-enoate
CID 175369896
2-[2-hydroxyethoxy-methoxy-[3-(oxiran-2-ylmethoxy)propyl]silyl]oxyethanol
CID 87722976
butan-2-one;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174775957
2-(4,4-diethoxybutoxymethyl)oxirane
CID 87292849
2-(4-methoxybutoxymethyl)oxirane
CID 58151519
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane?
The IUPAC name of 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane (CID 175337503) is 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane.
What is the SMILES notation for 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane?
The canonical SMILES for 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane is COC(CC[Si](OC)(OC)OC(C)CCCOCC1CO1)OC.
What is the InChIKey of 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane?
The InChIKey is DXXHMYIMAYEZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O7Si/c1-13(7-6-9-20-11-14-12-21-14)22-23(18-4,19-5)10-8-15(16-2)17-3/h13-15H,6-12H2,1-5H3.
What are the key properties of 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane?
3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane has a molecular weight of 352.50 g/mol, XLogP of 1.83, 15 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethoxypropyl-dimethoxy-[5-(oxiran-2-ylmethoxy)pentan-2-yloxy]silane is sourced from PubChem (CID 175337503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).