(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane

C12H22Si — CID 15878340

IUPAC(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane
SMILESCCCCC1C=CC=C1[Si](C)(C)C
InChIInChI=1S/C12H22Si/c1-5-6-8-11-9-7-10-12(11)13(2,3)4/h7,9-11H,5-6,8H2,1-4H3
InChIKeyPJXSPHRWOSGSMS-UHFFFAOYSA-N
MW194.39 g/mol
LogP4.17
Rot. Bonds4

About (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane

(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane (PubChem CID 15878340) has the molecular formula C12H22Si and a molecular weight of 194.39 g/mol. Its IUPAC name is (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane
PubChem CID15878340
Molecular FormulaC12H22Si
Molecular Weight194.39 g/mol
Exact Mass194.15
IUPAC Name(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane
SMILESCCCCC1C=CC=C1[Si](C)(C)C
InChIInChI=1S/C12H22Si/c1-5-6-8-11-9-7-10-12(11)13(2,3)4/h7,9-11H,5-6,8H2,1-4H3
InChIKeyPJXSPHRWOSGSMS-UHFFFAOYSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.39
LogP ≤ 54.17
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

2-Trimethylsilylbicyclo [2.2.1]-hept-2,5-diene
CID 12578034
7,8-Bis(trimethylsilyl)bicyclo[4.2.1]nona-2,4,7-triene
CID 564252
[(E)-2-(cyclopenten-1-yl)ethenyl]-trimethylsilane
CID 14175462
Trimethyl-2-(3-cyclohexenyl)ethylsilane
CID 23261216
(5-Tert-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane
CID 134888747
(2-Ethylcyclopenta-2,4-dien-1-yl)(trimethyl)silane
CID 4441236
1-Ethenyl-3 (1-hexenyl)-4-trimethylsilyl cyclopentane
CID 551987
Trimethyl-(5-propan-2-ylcyclopenta-1,3-dien-1-yl)silane
CID 12547573
1-t-Butyl-5-trimethylsilyl-1,3-cyclohexadiene
CID 14984258
[(Z)-(3,5-dimethylcyclohex-2-en-1-ylidene)methyl]-trimethylsilane
CID 15040722
(Trimethylsilyl)isopropenylcyclopentadiene
CID 129813269
[(1R,6S)-7-bicyclo[4.2.1]nona-2,4,7-trienyl]-trimethylsilane
CID 134860399

Frequently Asked Questions

What is the IUPAC name of (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane?
The IUPAC name of (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane (CID 15878340) is (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane.
What is the SMILES notation for (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane?
The canonical SMILES for (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane is CCCCC1C=CC=C1[Si](C)(C)C.
What is the InChIKey of (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane?
The InChIKey is PJXSPHRWOSGSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22Si/c1-5-6-8-11-9-7-10-12(11)13(2,3)4/h7,9-11H,5-6,8H2,1-4H3.
What are the key properties of (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane?
(5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane has a molecular weight of 194.39 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5-butylcyclopenta-1,3-dien-1-yl)-trimethylsilane is sourced from PubChem (CID 15878340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).