[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane

C16H30Si — CID 13280452

IUPAC[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane
SMILESCC(C)(C)C1CC=C(C2([Si](C)(C)C)CC2)CC1
InChIInChI=1S/C16H30Si/c1-15(2,3)13-7-9-14(10-8-13)16(11-12-16)17(4,5)6/h9,13H,7-8,10-12H2,1-6H3
InChIKeyWEQHROCJHKSMDJ-UHFFFAOYSA-N
MW250.50 g/mol
LogP5.63
Rot. Bonds2

About [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane

[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane (PubChem CID 13280452) has the molecular formula C16H30Si and a molecular weight of 250.50 g/mol. Its IUPAC name is [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane.

Molecular Properties

Compound Name[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane
PubChem CID13280452
Molecular FormulaC16H30Si
Molecular Weight250.50 g/mol
Exact Mass250.21
IUPAC Name[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane
SMILESCC(C)(C)C1CC=C(C2([Si](C)(C)C)CC2)CC1
InChIInChI=1S/C16H30Si/c1-15(2,3)13-7-9-14(10-8-13)16(11-12-16)17(4,5)6/h9,13H,7-8,10-12H2,1-6H3
InChIKeyWEQHROCJHKSMDJ-UHFFFAOYSA-N
XLogP5.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.50
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-(4-Tert-butylcyclohexen-1-yl)ethynyl-trimethylsilane
CID 10823617
CID 54222867
CID 54222867
2-(4-Tert-butylcyclohexylidene)ethyl-trimethylsilane
CID 10922619
4-Tert-butyl-1-cyclopropylcyclohexene
CID 11095204
trimethyl-[(1E,3E)-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]silane
CID 11470674
trimethyl-[2-[[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]methyl]cyclopropen-1-yl]silane
CID 71489379
[(E)-4-(4-tert-butylcyclohexylidene)but-2-enyl]-trimethylsilane
CID 101077362
Trimethyl-[2-[(3-methylcyclohex-2-en-1-yl)methyl]cyclopropen-1-yl]silane
CID 134861625
(4R)-1-methyl-4-(1-methylcyclopropyl)cyclohexene
CID 134961309
[(Z)-4-(4-tert-butylcyclohexylidene)but-2-enyl]-trimethylsilane
CID 134993728
trimethyl-[2-[[(2S)-4-methyl-2-bicyclo[3.1.1]hept-3-enyl]methyl]cyclopropen-1-yl]silane
CID 164665436
Trimethyl-[1-(3-methylcyclohex-2-en-1-yl)buta-2,3-dien-2-yl]silane
CID 164684829

Frequently Asked Questions

What is the IUPAC name of [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane?
The IUPAC name of [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane (CID 13280452) is [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane.
What is the SMILES notation for [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane?
The canonical SMILES for [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane is CC(C)(C)C1CC=C(C2([Si](C)(C)C)CC2)CC1.
What is the InChIKey of [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane?
The InChIKey is WEQHROCJHKSMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30Si/c1-15(2,3)13-7-9-14(10-8-13)16(11-12-16)17(4,5)6/h9,13H,7-8,10-12H2,1-6H3.
What are the key properties of [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane?
[1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane has a molecular weight of 250.50 g/mol, XLogP of 5.63, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-tert-butylcyclohexen-1-yl)cyclopropyl]-trimethylsilane is sourced from PubChem (CID 13280452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).