CID 174729493

CH7AlO3Si — CID 174729493

IUPAC—
SMILESO=C(O)O.[AlH2].[SiH3]
InChIInChI=1S/CH2O3.Al.H3Si.2H/c2-1(3)4;;;;/h(H2,2,3,4);;1H3;;
InChIKeyLISSRRIAMOWWHF-UHFFFAOYSA-N
MW122.13 g/mol
LogP-1.88
Rot. Bonds

About CID 174729493

CID 174729493 (PubChem CID 174729493) has the molecular formula CH7AlO3Si and a molecular weight of 122.13 g/mol.

Molecular Properties

Compound NameCID 174729493
PubChem CID174729493
Molecular FormulaCH7AlO3Si
Molecular Weight122.13 g/mol
Exact Mass122.00
IUPAC Name—
SMILESO=C(O)O.[AlH2].[SiH3]
InChIInChI=1S/CH2O3.Al.H3Si.2H/c2-1(3)4;;;;/h(H2,2,3,4);;1H3;;
InChIKeyLISSRRIAMOWWHF-UHFFFAOYSA-N
XLogP-1.88
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.13
LogP ≤ 5-1.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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 CID 174729493?
The IUPAC name of CID 174729493 (CID 174729493) is not available.
What is the SMILES notation for CID 174729493?
The canonical SMILES for CID 174729493 is O=C(O)O.[AlH2].[SiH3].
What is the InChIKey of CID 174729493?
The InChIKey is LISSRRIAMOWWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O3.Al.H3Si.2H/c2-1(3)4;;;;/h(H2,2,3,4);;1H3;;.
What are the key properties of CID 174729493?
CID 174729493 has a molecular weight of 122.13 g/mol, XLogP of -1.88, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174729493 is sourced from PubChem (CID 174729493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).