ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate

C12H40O6Si2 — CID 158396193

IUPACethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate
SMILESC.C.CC[Si](C)(O)OC.CC[Si](C)(OC)OC.CO.O
InChIInChI=1S/C5H14O2Si.C4H12O2Si.CH4O.2CH4.H2O/c1-5-8(4,6-2)7-3;1-4-7(3,5)6-2;1-2;;;/h5H2,1-4H3;5H,4H2,1-3H3;2H,1H3;2*1H4;1H2
InChIKeySBBWTNJQJAYSLG-UHFFFAOYSA-N
MW336.62 g/mol
LogP2.14
Rot. Bonds5

About ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate

ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate (PubChem CID 158396193) has the molecular formula C12H40O6Si2 and a molecular weight of 336.62 g/mol. Its IUPAC name is ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate.

Molecular Properties

Compound Nameethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate
PubChem CID158396193
Molecular FormulaC12H40O6Si2
Molecular Weight336.62 g/mol
Exact Mass336.24
IUPAC Nameethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate
SMILESC.C.CC[Si](C)(O)OC.CC[Si](C)(OC)OC.CO.O
InChIInChI=1S/C5H14O2Si.C4H12O2Si.CH4O.2CH4.H2O/c1-5-8(4,6-2)7-3;1-4-7(3,5)6-2;1-2;;;/h5H2,1-4H3;5H,4H2,1-3H3;2H,1H3;2*1H4;1H2
InChIKeySBBWTNJQJAYSLG-UHFFFAOYSA-N
XLogP2.14
TPSA99.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.62
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The IUPAC name of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate (CID 158396193) is ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate.
What is the SMILES notation for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The canonical SMILES for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate is C.C.CC[Si](C)(O)OC.CC[Si](C)(OC)OC.CO.O.
What is the InChIKey of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The InChIKey is SBBWTNJQJAYSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14O2Si.C4H12O2Si.CH4O.2CH4.H2O/c1-5-8(4,6-2)7-3;1-4-7(3,5)6-2;1-2;;;/h5H2,1-4H3;5H,4H2,1-3H3;2H,1H3;2*1H4;1H2.
What are the key properties of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate has a molecular weight of 336.62 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate is sourced from PubChem (CID 158396193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).