[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane

C18H38Si — CID 91087956

IUPAC[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane
SMILESC=C(C(CCC(C)(C)C)CC[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C18H38Si/c1-15(18(5,6)7)16(11-13-17(2,3)4)12-14-19(8,9)10/h16H,1,11-14H2,2-10H3
InChIKeyQQFVPUNXTJLQRG-UHFFFAOYSA-N
MW282.59 g/mol
LogP6.76
Rot. Bonds6

About [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane

[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane (PubChem CID 91087956) has the molecular formula C18H38Si and a molecular weight of 282.59 g/mol. Its IUPAC name is [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane.

Molecular Properties

Compound Name[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane
PubChem CID91087956
Molecular FormulaC18H38Si
Molecular Weight282.59 g/mol
Exact Mass282.27
IUPAC Name[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane
SMILESC=C(C(CCC(C)(C)C)CC[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C18H38Si/c1-15(18(5,6)7)16(11-13-17(2,3)4)12-14-19(8,9)10/h16H,1,11-14H2,2-10H3
InChIKeyQQFVPUNXTJLQRG-UHFFFAOYSA-N
XLogP6.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.59
LogP ≤ 56.76
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

Trimethyl(3-methylpentadec-1-en-2-yl)silane
CID 44477720
2-(4-Tert-butylcyclohexyl)prop-2-enyl-trimethylsilane
CID 86100684
trimethyl-[[(1S)-2-methylidenecycloheptyl]methyl]silane
CID 139263557
Trimethyl(5-methylpentadec-14-en-6-yl)silane
CID 20725099
2,4,6,8-Tetramethyl-6-(2-methylpropyl)non-1-ene
CID 21361186
2,2-Dimethyl-5-prop-1-en-2-yltridecane
CID 57153618
2,6,8,8-Tetramethyl-5,9-dimethylidenedodec-1-ene
CID 59927476
6-Ethyl-2,6,9,13-tetramethyl-4,11-dimethylidenepentadecane
CID 91299152
(2-Tert-butyl-3,4,4-trimethylpent-1-enyl)-trimethylsilane
CID 91446102
Dimethyl-(2,2,7,7-tetramethyl-6-methylideneoctan-4-yl)-trimethylsilyloxysilane
CID 91458960
2,2,4,4,8-Pentamethyl-6-methylidenedecane
CID 91487026
3,3,5,5,9-Pentamethyl-7-methylideneundecane
CID 91578929

Frequently Asked Questions

What is the IUPAC name of [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane?
The IUPAC name of [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane (CID 91087956) is [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane.
What is the SMILES notation for [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane?
The canonical SMILES for [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane is C=C(C(CCC(C)(C)C)CC[Si](C)(C)C)C(C)(C)C.
What is the InChIKey of [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane?
The InChIKey is QQFVPUNXTJLQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38Si/c1-15(18(5,6)7)16(11-13-17(2,3)4)12-14-19(8,9)10/h16H,1,11-14H2,2-10H3.
What are the key properties of [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane?
[3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane has a molecular weight of 282.59 g/mol, XLogP of 6.76, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3,3-dimethylbut-1-en-2-yl)-6,6-dimethylheptyl]-trimethylsilane is sourced from PubChem (CID 91087956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).