CID 91426285

C9H19O2Si — CID 91426285

IUPAC—
SMILESCCCC=C[Si](OCC)OCC
InChIInChI=1S/C9H19O2Si/c1-4-7-8-9-12(10-5-2)11-6-3/h8-9H,4-7H2,1-3H3
InChIKeyGAQDQAYMHXYZGL-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.44
Rot. Bonds7

About CID 91426285

CID 91426285 (PubChem CID 91426285) has the molecular formula C9H19O2Si and a molecular weight of 187.33 g/mol.

Molecular Properties

Compound NameCID 91426285
PubChem CID91426285
Molecular FormulaC9H19O2Si
Molecular Weight187.33 g/mol
Exact Mass187.12
IUPAC Name—
SMILESCCCC=C[Si](OCC)OCC
InChIInChI=1S/C9H19O2Si/c1-4-7-8-9-12(10-5-2)11-6-3/h8-9H,4-7H2,1-3H3
InChIKeyGAQDQAYMHXYZGL-UHFFFAOYSA-N
XLogP2.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4Z,8E)-dodeca-4,8-diene
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(4E,8E)-dodeca-4,8-diene
CID 12576905
ethane;(E)-oct-4-ene
CID 142055407
(Z)-1-ethoxypent-1-ene
CID 12512190
1-ethoxyhept-3-ene
CID 547708
but-2-ene;hex-2-ene;oct-4-ene;ruthenium
CID 161087465
(4Z,7Z,10Z,13Z)-heptadeca-4,7,10,13-tetraene
CID 10473036
oct-4-enoxysilane
CID 154119837
(E)-1-methoxyhept-3-ene
CID 13049937
(E)-1-methoxyhex-2-ene
CID 5366215
1-fluoropent-1-ene
CID 54278285
tricosa-4,19-diene
CID 142680711

Frequently Asked Questions

What is the IUPAC name of CID 91426285?
The IUPAC name of CID 91426285 (CID 91426285) is not available.
What is the SMILES notation for CID 91426285?
The canonical SMILES for CID 91426285 is CCCC=C[Si](OCC)OCC.
What is the InChIKey of CID 91426285?
The InChIKey is GAQDQAYMHXYZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19O2Si/c1-4-7-8-9-12(10-5-2)11-6-3/h8-9H,4-7H2,1-3H3.
What are the key properties of CID 91426285?
CID 91426285 has a molecular weight of 187.33 g/mol, XLogP of 2.44, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 91426285 is sourced from PubChem (CID 91426285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).