(3,5-dioctylphenyl)-trimethylsilane

C25H46Si — CID 156630407

IUPAC(3,5-dioctylphenyl)-trimethylsilane
SMILESCCCCCCCCc1cc(CCCCCCCC)cc([Si](C)(C)C)c1
InChIInChI=1S/C25H46Si/c1-6-8-10-12-14-16-18-23-20-24(19-17-15-13-11-9-7-2)22-25(21-23)26(3,4)5/h20-22H,6-19H2,1-5H3
InChIKeyUCWVCVDZXDRAEB-UHFFFAOYSA-N
MW374.73 g/mol
LogP8.04
Rot. Bonds15

About (3,5-dioctylphenyl)-trimethylsilane

(3,5-dioctylphenyl)-trimethylsilane (PubChem CID 156630407) has the molecular formula C25H46Si and a molecular weight of 374.73 g/mol. Its IUPAC name is (3,5-dioctylphenyl)-trimethylsilane.

Molecular Properties

Compound Name(3,5-dioctylphenyl)-trimethylsilane
PubChem CID156630407
Molecular FormulaC25H46Si
Molecular Weight374.73 g/mol
Exact Mass374.34
IUPAC Name(3,5-dioctylphenyl)-trimethylsilane
SMILESCCCCCCCCc1cc(CCCCCCCC)cc([Si](C)(C)C)c1
InChIInChI=1S/C25H46Si/c1-6-8-10-12-14-16-18-23-20-24(19-17-15-13-11-9-7-2)22-25(21-23)26(3,4)5/h20-22H,6-19H2,1-5H3
InChIKeyUCWVCVDZXDRAEB-UHFFFAOYSA-N
XLogP8.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.73
LogP ≤ 58.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

1-butyl-3,5-di(tetradecyl)benzene
CID 91192270
(4-decylphenyl)-trimethylsilane
CID 69331769
3-butyl-5-trimethylsilylphenol
CID 135075796
1-ethyl-3,5-di(tetradecyl)benzene
CID 91801932
1,3-didecyl-5-(3,5-didecylphenyl)benzene
CID 150677432
1-methyl-3,5-di(pentadecyl)benzene
CID 58289216
(3,5-dihexylphenyl)methanamine
CID 174558763
1-ethyl-3-heptyl-5-propylbenzene
CID 141210303
(3,5-dihexylphenyl)-(2,5-dimethylcyclopenta-2,4-dien-1-yl)-dimethylsilane;titanium(4+);trichloride
CID 173384390
trimethyl-(6-pentylnaphthalen-2-yl)silane
CID 132535559
(2,6-difluoro-4-pentylphenyl)-trimethylsilane
CID 15751979
(3,5-dihexylphenyl)-(2,3-dimethylcyclopenta-2,4-dien-1-yl)-dimethylsilane
CID 173383512

Frequently Asked Questions

What is the IUPAC name of (3,5-dioctylphenyl)-trimethylsilane?
The IUPAC name of (3,5-dioctylphenyl)-trimethylsilane (CID 156630407) is (3,5-dioctylphenyl)-trimethylsilane.
What is the SMILES notation for (3,5-dioctylphenyl)-trimethylsilane?
The canonical SMILES for (3,5-dioctylphenyl)-trimethylsilane is CCCCCCCCc1cc(CCCCCCCC)cc([Si](C)(C)C)c1.
What is the InChIKey of (3,5-dioctylphenyl)-trimethylsilane?
The InChIKey is UCWVCVDZXDRAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H46Si/c1-6-8-10-12-14-16-18-23-20-24(19-17-15-13-11-9-7-2)22-25(21-23)26(3,4)5/h20-22H,6-19H2,1-5H3.
What are the key properties of (3,5-dioctylphenyl)-trimethylsilane?
(3,5-dioctylphenyl)-trimethylsilane has a molecular weight of 374.73 g/mol, XLogP of 8.04, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dioctylphenyl)-trimethylsilane is sourced from PubChem (CID 156630407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).