tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane

C20H44Si — CID 91529208

IUPACtert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane
SMILESCC(C(C[Si](C)(C)C(C)(C)C)C(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H44Si/c1-15(18(3,4)5)17(16(2)19(6,7)8)14-21(12,13)20(9,10)11/h15-17H,14H2,1-13H3
InChIKeyTVDRNZKIGJVSAI-UHFFFAOYSA-N
MW312.66 g/mol
LogP7.48
Rot. Bonds4

About tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane

tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane (PubChem CID 91529208) has the molecular formula C20H44Si and a molecular weight of 312.66 g/mol. Its IUPAC name is tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane
PubChem CID91529208
Molecular FormulaC20H44Si
Molecular Weight312.66 g/mol
Exact Mass312.32
IUPAC Nametert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane
SMILESCC(C(C[Si](C)(C)C(C)(C)C)C(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H44Si/c1-15(18(3,4)5)17(16(2)19(6,7)8)14-21(12,13)20(9,10)11/h15-17H,14H2,1-13H3
InChIKeyTVDRNZKIGJVSAI-UHFFFAOYSA-N
XLogP7.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.66
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-(2-tert-butyl-4,4-dimethylpentyl)-dimethylsilane
CID 123259940
tert-butyl-dimethyl-(trimethylsilylmethyl)silane
CID 140986210
trimethyl-(3,4,4-trimethyl-2-trimethylsilylpentan-2-yl)silane
CID 10848841
N-[2-[tert-butyl(dimethyl)silyl]ethyl]-2-methylpropan-1-amine
CID 101135291
2,2,3,5-tetramethyl-4-(2-methylpropyl)octane
CID 90766744
2,2,3,4-tetramethylhexane
CID 91324153
1-chloro-2,3,4,4-tetramethylpentane
CID 54014199
[3,3-dimethylbutan-2-yloxy(dimethyl)silyl]formonitrile
CID 14874584
ditert-butyl-methyl-propan-2-ylsilane
CID 140729295
(2R,3S)-3,4,4-trimethylpentan-2-ol
CID 58403064
tert-butyl-[(tert-butyl-chloro-methylsilyl)methyl]-dimethylsilane
CID 140979783
2,2,3,4,5-pentamethylheptane
CID 53428630

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane?
The IUPAC name of tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane (CID 91529208) is tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane is CC(C(C[Si](C)(C)C(C)(C)C)C(C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane?
The InChIKey is TVDRNZKIGJVSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44Si/c1-15(18(3,4)5)17(16(2)19(6,7)8)14-21(12,13)20(9,10)11/h15-17H,14H2,1-13H3.
What are the key properties of tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane?
tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane has a molecular weight of 312.66 g/mol, XLogP of 7.48, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(3,3-dimethylbutan-2-yl)-3,4,4-trimethylpentyl]-dimethylsilane is sourced from PubChem (CID 91529208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).