isocyanic acid;methoxy(trimethyl)silane

C5H13NO2Si — CID 172832895

IUPACisocyanic acid;methoxy(trimethyl)silane
SMILESCO[Si](C)(C)C.N=C=O
InChIInChI=1S/C4H12OSi.CHNO/c1-5-6(2,3)4;2-1-3/h1-4H3;2H
InChIKeyVTEWKQVIELQGBM-UHFFFAOYSA-N
MW147.25 g/mol
LogP1.37
Rot. Bonds1

About isocyanic acid;methoxy(trimethyl)silane

isocyanic acid;methoxy(trimethyl)silane (PubChem CID 172832895) has the molecular formula C5H13NO2Si and a molecular weight of 147.25 g/mol. Its IUPAC name is isocyanic acid;methoxy(trimethyl)silane.

Molecular Properties

Compound Nameisocyanic acid;methoxy(trimethyl)silane
PubChem CID172832895
Molecular FormulaC5H13NO2Si
Molecular Weight147.25 g/mol
Exact Mass147.07
IUPAC Nameisocyanic acid;methoxy(trimethyl)silane
SMILESCO[Si](C)(C)C.N=C=O
InChIInChI=1S/C4H12OSi.CHNO/c1-5-6(2,3)4;2-1-3/h1-4H3;2H
InChIKeyVTEWKQVIELQGBM-UHFFFAOYSA-N
XLogP1.37
TPSA50.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.25
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of isocyanic acid;methoxy(trimethyl)silane?
The IUPAC name of isocyanic acid;methoxy(trimethyl)silane (CID 172832895) is isocyanic acid;methoxy(trimethyl)silane.
What is the SMILES notation for isocyanic acid;methoxy(trimethyl)silane?
The canonical SMILES for isocyanic acid;methoxy(trimethyl)silane is CO[Si](C)(C)C.N=C=O.
What is the InChIKey of isocyanic acid;methoxy(trimethyl)silane?
The InChIKey is VTEWKQVIELQGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12OSi.CHNO/c1-5-6(2,3)4;2-1-3/h1-4H3;2H.
What are the key properties of isocyanic acid;methoxy(trimethyl)silane?
isocyanic acid;methoxy(trimethyl)silane has a molecular weight of 147.25 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for isocyanic acid;methoxy(trimethyl)silane is sourced from PubChem (CID 172832895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).