hydroxy(trimethoxy)silane;hydrate

C3H12O5Si — CID 173471201

IUPAChydroxy(trimethoxy)silane;hydrate
SMILESCO[Si](O)(OC)OC.O
InChIInChI=1S/C3H10O4Si.H2O/c1-5-8(4,6-2)7-3;/h4H,1-3H3;1H2
InChIKeyBDAORFINUPZULA-UHFFFAOYSA-N
MW156.21 g/mol
LogP-1.47
Rot. Bonds3

About hydroxy(trimethoxy)silane;hydrate

hydroxy(trimethoxy)silane;hydrate (PubChem CID 173471201) has the molecular formula C3H12O5Si and a molecular weight of 156.21 g/mol. Its IUPAC name is hydroxy(trimethoxy)silane;hydrate.

Molecular Properties

Compound Namehydroxy(trimethoxy)silane;hydrate
PubChem CID173471201
Molecular FormulaC3H12O5Si
Molecular Weight156.21 g/mol
Exact Mass156.05
IUPAC Namehydroxy(trimethoxy)silane;hydrate
SMILESCO[Si](O)(OC)OC.O
InChIInChI=1S/C3H10O4Si.H2O/c1-5-8(4,6-2)7-3;/h4H,1-3H3;1H2
InChIKeyBDAORFINUPZULA-UHFFFAOYSA-N
XLogP-1.47
TPSA79.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 5-1.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 hydroxy(trimethoxy)silane;hydrate?
The IUPAC name of hydroxy(trimethoxy)silane;hydrate (CID 173471201) is hydroxy(trimethoxy)silane;hydrate.
What is the SMILES notation for hydroxy(trimethoxy)silane;hydrate?
The canonical SMILES for hydroxy(trimethoxy)silane;hydrate is CO[Si](O)(OC)OC.O.
What is the InChIKey of hydroxy(trimethoxy)silane;hydrate?
The InChIKey is BDAORFINUPZULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10O4Si.H2O/c1-5-8(4,6-2)7-3;/h4H,1-3H3;1H2.
What are the key properties of hydroxy(trimethoxy)silane;hydrate?
hydroxy(trimethoxy)silane;hydrate has a molecular weight of 156.21 g/mol, XLogP of -1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy(trimethoxy)silane;hydrate is sourced from PubChem (CID 173471201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).