CID 155661829

C16H26ISi — CID 155661829

IUPAC—
SMILESCCC(C)(C)CC[Si](I)C(C)(C)c1ccccc1
InChIInChI=1S/C16H26ISi/c1-6-15(2,3)12-13-18(17)16(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13H2,1-5H3
InChIKeyUIRMKJWBLICGPV-UHFFFAOYSA-N
MW373.37 g/mol
LogP5.76
Rot. Bonds6

About CID 155661829

CID 155661829 (PubChem CID 155661829) has the molecular formula C16H26ISi and a molecular weight of 373.37 g/mol.

Molecular Properties

Compound NameCID 155661829
PubChem CID155661829
Molecular FormulaC16H26ISi
Molecular Weight373.37 g/mol
Exact Mass373.08
IUPAC Name—
SMILESCCC(C)(C)CC[Si](I)C(C)(C)c1ccccc1
InChIInChI=1S/C16H26ISi/c1-6-15(2,3)12-13-18(17)16(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13H2,1-5H3
InChIKeyUIRMKJWBLICGPV-UHFFFAOYSA-N
XLogP5.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.37
LogP ≤ 55.76
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 155661823
CID 155661823
(4,4-dimethyl-2-phenylhexan-2-yl)benzene
CID 59841354
CID 142554279
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ethane;3-methylpentan-3-ylbenzene
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(5,5-dimethyl-1-phenylheptyl)benzene
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3,3,4,5,5-pentamethylheptan-4-ylbenzene
CID 144815892
3-phenylhexan-3-amine
CID 60794511
3-phenylpentan-3-amine;2-phenylpropan-2-amine
CID 67930723
azane;2,2-dimethylbutylbenzene
CID 175285583
(3-ethyl-4,4-dimethylhexan-3-yl)benzene
CID 147184303
2-chlorobutan-2-ylbenzene;ethane
CID 123404536
2-[2-[2-[2-(2-phenylbutan-2-ylperoxy)butan-2-ylperoxy]butan-2-ylperoxy]butan-2-ylperoxy]butan-2-ylbenzene
CID 171749550

Frequently Asked Questions

What is the IUPAC name of CID 155661829?
The IUPAC name of CID 155661829 (CID 155661829) is not available.
What is the SMILES notation for CID 155661829?
The canonical SMILES for CID 155661829 is CCC(C)(C)CC[Si](I)C(C)(C)c1ccccc1.
What is the InChIKey of CID 155661829?
The InChIKey is UIRMKJWBLICGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26ISi/c1-6-15(2,3)12-13-18(17)16(4,5)14-10-8-7-9-11-14/h7-11H,6,12-13H2,1-5H3.
What are the key properties of CID 155661829?
CID 155661829 has a molecular weight of 373.37 g/mol, XLogP of 5.76, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155661829 is sourced from PubChem (CID 155661829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).