dibutyl-tert-butyl-methylsilane

C13H30Si — CID 158335280

IUPACdibutyl-tert-butyl-methylsilane
SMILESCCCC[Si](C)(CCCC)C(C)(C)C
InChIInChI=1S/C13H30Si/c1-7-9-11-14(6,12-10-8-2)13(3,4)5/h7-12H2,1-6H3
InChIKeySMCCSHZXTURTBI-UHFFFAOYSA-N
MW214.47 g/mol
LogP5.47
Rot. Bonds6

About dibutyl-tert-butyl-methylsilane

dibutyl-tert-butyl-methylsilane (PubChem CID 158335280) has the molecular formula C13H30Si and a molecular weight of 214.47 g/mol. Its IUPAC name is dibutyl-tert-butyl-methylsilane.

Molecular Properties

Compound Namedibutyl-tert-butyl-methylsilane
PubChem CID158335280
Molecular FormulaC13H30Si
Molecular Weight214.47 g/mol
Exact Mass214.21
IUPAC Namedibutyl-tert-butyl-methylsilane
SMILESCCCC[Si](C)(CCCC)C(C)(C)C
InChIInChI=1S/C13H30Si/c1-7-9-11-14(6,12-10-8-2)13(3,4)5/h7-12H2,1-6H3
InChIKeySMCCSHZXTURTBI-UHFFFAOYSA-N
XLogP5.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500214.47
LogP ≤ 55.47
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-methyl-dipropylsilane
CID 141134978
butyl(trimethyl)silane;tert-butyl(trimethyl)silane;ethyl(trimethyl)silane;tetramethylsilane;triethyl(methyl)silane;trimethyl(propyl)silane
CID 159050720
1-[[(butyl-chloro-methylsilyl)amino]-chloro-methylsilyl]butane
CID 141041287
dibromo-butyl-methylsilane
CID 140744808
pentane;tetramethylsilane
CID 173025791
butyl-methoxy-methyl-[(2-methylpropan-2-yl)oxy]silane
CID 139614116
2,3-dimethylbutan-2-yl-dimethyl-tetradecylsilane
CID 151433701
butyl-heptyl-methyl-octylsilane
CID 168803305
butyl-dimethyl-undecylsilane
CID 54018421
dibutyl-heptyl-methylsilane
CID 168803311
butyl(triethoxy)silane;tert-butyl(triethoxy)silane
CID 175188929
butyl-chloro-methyl-pentylsilane
CID 87411075

Frequently Asked Questions

What is the IUPAC name of dibutyl-tert-butyl-methylsilane?
The IUPAC name of dibutyl-tert-butyl-methylsilane (CID 158335280) is dibutyl-tert-butyl-methylsilane.
What is the SMILES notation for dibutyl-tert-butyl-methylsilane?
The canonical SMILES for dibutyl-tert-butyl-methylsilane is CCCC[Si](C)(CCCC)C(C)(C)C.
What is the InChIKey of dibutyl-tert-butyl-methylsilane?
The InChIKey is SMCCSHZXTURTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30Si/c1-7-9-11-14(6,12-10-8-2)13(3,4)5/h7-12H2,1-6H3.
What are the key properties of dibutyl-tert-butyl-methylsilane?
dibutyl-tert-butyl-methylsilane has a molecular weight of 214.47 g/mol, XLogP of 5.47, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-tert-butyl-methylsilane is sourced from PubChem (CID 158335280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).