CID 58391631

C8H17OSi — CID 58391631

IUPAC—
SMILESCC(=O)CCCC[Si](C)C
InChIInChI=1S/C8H17OSi/c1-8(9)6-4-5-7-10(2)3/h4-7H2,1-3H3
InChIKeyDAMPWBYANBOIFA-UHFFFAOYSA-N
MW157.31 g/mol
LogP2.50
Rot. Bonds5

About CID 58391631

CID 58391631 (PubChem CID 58391631) has the molecular formula C8H17OSi and a molecular weight of 157.31 g/mol.

Molecular Properties

Compound NameCID 58391631
PubChem CID58391631
Molecular FormulaC8H17OSi
Molecular Weight157.31 g/mol
Exact Mass157.10
IUPAC Name—
SMILESCC(=O)CCCC[Si](C)C
InChIInChI=1S/C8H17OSi/c1-8(9)6-4-5-7-10(2)3/h4-7H2,1-3H3
InChIKeyDAMPWBYANBOIFA-UHFFFAOYSA-N
XLogP2.50
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.31
LogP ≤ 52.50
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'}

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Related Compounds

Silane, trimethyl(1-oxohexyl)-
CID 163012
4-(Trimethylsilyl)cyclohexanone
CID 4060849
3-Trimethylsilylcyclopentan-1-one
CID 14001618
6-Trimethylsilylhexan-4-one
CID 14112750
1-Trimethylsilylpentan-2-one
CID 12457306
2-[Tert-butyl(dimethyl)silyl]hexan-3-one
CID 15033613
Cyclohexanone, 3-(trimethylsilyl)-
CID 10964964
1-Heptyn-3-one, 1-(trimethylsilyl)-
CID 11019511
1-Trimethylsilyloctan-4-one
CID 60040811
Butyldimethylsilylpentadione
CID 87854103
Silacycloheptan-4-one, 1,1-dimethyl-
CID 574917
5-(Trimethylsilyl)-2-pentanone
CID 575386

Frequently Asked Questions

What is the IUPAC name of CID 58391631?
The IUPAC name of CID 58391631 (CID 58391631) is not available.
What is the SMILES notation for CID 58391631?
The canonical SMILES for CID 58391631 is CC(=O)CCCC[Si](C)C.
What is the InChIKey of CID 58391631?
The InChIKey is DAMPWBYANBOIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17OSi/c1-8(9)6-4-5-7-10(2)3/h4-7H2,1-3H3.
What are the key properties of CID 58391631?
CID 58391631 has a molecular weight of 157.31 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58391631 is sourced from PubChem (CID 58391631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).