trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane

C17H28Si — CID 164685517

IUPACtrimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane
SMILESC=C=C(C[C@H]1C[C@@H](C(=C)C)CC=C1C)[Si](C)(C)C
InChIInChI=1S/C17H28Si/c1-8-17(18(5,6)7)12-16-11-15(13(2)3)10-9-14(16)4/h9,15-16H,1-2,10-12H2,3-7H3/t15-,16+/m0/s1
InChIKeyPBONREKJDOGDHE-JKSUJKDBSA-N
MW260.50 g/mol
LogP5.51
Rot. Bonds4

About trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane

trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane (PubChem CID 164685517) has the molecular formula C17H28Si and a molecular weight of 260.50 g/mol. Its IUPAC name is trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane.

Molecular Properties

Compound Nametrimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane
PubChem CID164685517
Molecular FormulaC17H28Si
Molecular Weight260.50 g/mol
Exact Mass260.20
IUPAC Nametrimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane
SMILESC=C=C(C[C@H]1C[C@@H](C(=C)C)CC=C1C)[Si](C)(C)C
InChIInChI=1S/C17H28Si/c1-8-17(18(5,6)7)12-16-11-15(13(2)3)10-9-14(16)4/h9,15-16H,1-2,10-12H2,3-7H3/t15-,16+/m0/s1
InChIKeyPBONREKJDOGDHE-JKSUJKDBSA-N
XLogP5.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.50
LogP ≤ 55.51
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

Chloro(2-(3-cyclohexen-1-yl)ethyl)dimethylsilane
CID 3538150
Silane, (1-cyclohexen-1-ylmethyl)trimethyl-
CID 10964921
Trimethyl-[[4-(trifluoromethyl)cyclohexen-1-yl]methyl]silane
CID 12937206
Trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane
CID 12937207
[(E)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 11252579
[(Z)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 13215154
[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]-trimethylsilane
CID 134993439
(4-Tert-butyl-1-cyclohexen-1-yl)(trimethyl)silane
CID 11052929
Trimethyl-2-(3-cyclohexenyl)ethylsilane
CID 23261216
CID 54222867
CID 54222867
[1-[(2,6-Dimethyl-2-cyclohexen-1-ylidene)methyl]cyclopropyl](trimethyl)silane
CID 117069516
trimethyl-[4-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]buta-1,3-diynyl]silane
CID 11085963

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane?
The IUPAC name of trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane (CID 164685517) is trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane.
What is the SMILES notation for trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane?
The canonical SMILES for trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane is C=C=C(C[C@H]1C[C@@H](C(=C)C)CC=C1C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane?
The InChIKey is PBONREKJDOGDHE-JKSUJKDBSA-N. The full InChI is InChI=1S/C17H28Si/c1-8-17(18(5,6)7)12-16-11-15(13(2)3)10-9-14(16)4/h9,15-16H,1-2,10-12H2,3-7H3/t15-,16+/m0/s1.
What are the key properties of trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane?
trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane has a molecular weight of 260.50 g/mol, XLogP of 5.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]buta-2,3-dien-2-yl]silane is sourced from PubChem (CID 164685517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).