CID 172554263

C16H33O3Si — CID 172554263

IUPAC—
SMILESCCCCCCCCCCCCCCCCOOO[Si]
InChIInChI=1S/C16H33O3Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h2-16H2,1H3
InChIKeyPDASCARUITUBMY-UHFFFAOYSA-N
MW301.52 g/mol
LogP5.43
Rot. Bonds17

About CID 172554263

CID 172554263 (PubChem CID 172554263) has the molecular formula C16H33O3Si and a molecular weight of 301.52 g/mol.

Molecular Properties

Compound NameCID 172554263
PubChem CID172554263
Molecular FormulaC16H33O3Si
Molecular Weight301.52 g/mol
Exact Mass301.22
IUPAC Name—
SMILESCCCCCCCCCCCCCCCCOOO[Si]
InChIInChI=1S/C16H33O3Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h2-16H2,1H3
InChIKeyPDASCARUITUBMY-UHFFFAOYSA-N
XLogP5.43
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.52
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

1-butylperoxyperoxynonane
CID 90169675
1-butoxyperoxynonane
CID 90110144
1-propoxyperoxyundecane
CID 90109462
1-propylperoxyperoxydodecane
CID 90108856
CID 178078654
CID 178078654
1-octylperoxynonane
CID 151564626
CID 11819822
CID 11819822
octoxy-λ2-stannane
CID 173007651
1-pentylperoxypentane;sulfane
CID 174916685
1-(trioxidanylperoxyperoxy)hexadecane
CID 141273447
1-methylperoxydecane
CID 20726912
1-methylperoxydocosane
CID 173387093

Frequently Asked Questions

What is the IUPAC name of CID 172554263?
The IUPAC name of CID 172554263 (CID 172554263) is not available.
What is the SMILES notation for CID 172554263?
The canonical SMILES for CID 172554263 is CCCCCCCCCCCCCCCCOOO[Si].
What is the InChIKey of CID 172554263?
The InChIKey is PDASCARUITUBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33O3Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h2-16H2,1H3.
What are the key properties of CID 172554263?
CID 172554263 has a molecular weight of 301.52 g/mol, XLogP of 5.43, 17 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172554263 is sourced from PubChem (CID 172554263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).