CID 54073637

C3H7O2Si — CID 54073637

IUPAC—
SMILESCCCO[Si]=O
InChIInChI=1S/C3H7O2Si/c1-2-3-5-6-4/h2-3H2,1H3
InChIKeyMIERFIKMWSPDNB-UHFFFAOYSA-N
MW103.17 g/mol
LogP0.38
Rot. Bonds3

About CID 54073637

CID 54073637 (PubChem CID 54073637) has the molecular formula C3H7O2Si and a molecular weight of 103.17 g/mol.

Molecular Properties

Compound NameCID 54073637
PubChem CID54073637
Molecular FormulaC3H7O2Si
Molecular Weight103.17 g/mol
Exact Mass103.02
IUPAC Name—
SMILESCCCO[Si]=O
InChIInChI=1S/C3H7O2Si/c1-2-3-5-6-4/h2-3H2,1H3
InChIKeyMIERFIKMWSPDNB-UHFFFAOYSA-N
XLogP0.38
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 54073637?
The IUPAC name of CID 54073637 (CID 54073637) is not available.
What is the SMILES notation for CID 54073637?
The canonical SMILES for CID 54073637 is CCCO[Si]=O.
What is the InChIKey of CID 54073637?
The InChIKey is MIERFIKMWSPDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O2Si/c1-2-3-5-6-4/h2-3H2,1H3.
What are the key properties of CID 54073637?
CID 54073637 has a molecular weight of 103.17 g/mol, XLogP of 0.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 54073637 is sourced from PubChem (CID 54073637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).