CID 155661823

C15H24ISi — CID 155661823

IUPAC—
SMILESCCC(C)(C)C[Si](I)C(C)(C)c1ccccc1
InChIInChI=1S/C15H24ISi/c1-6-14(2,3)12-17(16)15(4,5)13-10-8-7-9-11-13/h7-11H,6,12H2,1-5H3
InChIKeyJXXOMCQGJOOBGH-UHFFFAOYSA-N
MW359.35 g/mol
LogP5.37
Rot. Bonds5

About CID 155661823

CID 155661823 (PubChem CID 155661823) has the molecular formula C15H24ISi and a molecular weight of 359.35 g/mol.

Molecular Properties

Compound NameCID 155661823
PubChem CID155661823
Molecular FormulaC15H24ISi
Molecular Weight359.35 g/mol
Exact Mass359.07
IUPAC Name—
SMILESCCC(C)(C)C[Si](I)C(C)(C)c1ccccc1
InChIInChI=1S/C15H24ISi/c1-6-14(2,3)12-17(16)15(4,5)13-10-8-7-9-11-13/h7-11H,6,12H2,1-5H3
InChIKeyJXXOMCQGJOOBGH-UHFFFAOYSA-N
XLogP5.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.35
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 155661829
CID 155661829
(4,4-dimethyl-2-phenylhexan-2-yl)benzene
CID 59841354
CID 142554279
CID 142554279
ethane;3-methylpentan-3-ylbenzene
CID 90745317
3,3,4,5,5-pentamethylheptan-4-ylbenzene
CID 144815892
azane;2,2-dimethylbutylbenzene
CID 175285583
(3-ethyl-4,4-dimethylhexan-3-yl)benzene
CID 147184303
2-chlorobutan-2-ylbenzene;ethane
CID 123404536
2-[3-[3-(2-phenylbutan-2-ylperoxy)pentan-3-ylperoxy]pentan-3-ylperoxy]butan-2-ylbenzene
CID 171749540
2-[2-[2-[2-(2-phenylbutan-2-ylperoxy)butan-2-ylperoxy]butan-2-ylperoxy]butan-2-ylperoxy]butan-2-ylbenzene
CID 171749550
triphenyl(2,4,4-trimethylhexan-2-yl)phosphanium
CID 144736397
1-(4-tert-butylphenyl)-1-phenylpropan-1-amine
CID 63408284

Frequently Asked Questions

What is the IUPAC name of CID 155661823?
The IUPAC name of CID 155661823 (CID 155661823) is not available.
What is the SMILES notation for CID 155661823?
The canonical SMILES for CID 155661823 is CCC(C)(C)C[Si](I)C(C)(C)c1ccccc1.
What is the InChIKey of CID 155661823?
The InChIKey is JXXOMCQGJOOBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ISi/c1-6-14(2,3)12-17(16)15(4,5)13-10-8-7-9-11-13/h7-11H,6,12H2,1-5H3.
What are the key properties of CID 155661823?
CID 155661823 has a molecular weight of 359.35 g/mol, XLogP of 5.37, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155661823 is sourced from PubChem (CID 155661823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).