CID 57019732

C9H19OSi — CID 57019732

IUPAC—
SMILESC=CCOCCCC[Si](C)C
InChIInChI=1S/C9H19OSi/c1-4-7-10-8-5-6-9-11(2)3/h4H,1,5-9H2,2-3H3
InChIKeyNBWRNSZKYKSZPW-UHFFFAOYSA-N
MW171.34 g/mol
LogP2.72
Rot. Bonds7

About CID 57019732

CID 57019732 (PubChem CID 57019732) has the molecular formula C9H19OSi and a molecular weight of 171.34 g/mol.

Molecular Properties

Compound NameCID 57019732
PubChem CID57019732
Molecular FormulaC9H19OSi
Molecular Weight171.34 g/mol
Exact Mass171.12
IUPAC Name—
SMILESC=CCOCCCC[Si](C)C
InChIInChI=1S/C9H19OSi/c1-4-7-10-8-5-6-9-11(2)3/h4H,1,5-9H2,2-3H3
InChIKeyNBWRNSZKYKSZPW-UHFFFAOYSA-N
XLogP2.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.34
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 57019732?
The IUPAC name of CID 57019732 (CID 57019732) is not available.
What is the SMILES notation for CID 57019732?
The canonical SMILES for CID 57019732 is C=CCOCCCC[Si](C)C.
What is the InChIKey of CID 57019732?
The InChIKey is NBWRNSZKYKSZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19OSi/c1-4-7-10-8-5-6-9-11(2)3/h4H,1,5-9H2,2-3H3.
What are the key properties of CID 57019732?
CID 57019732 has a molecular weight of 171.34 g/mol, XLogP of 2.72, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57019732 is sourced from PubChem (CID 57019732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).