triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane

C17H30Si — CID 154701868

IUPACtriethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane
SMILESC=C(C)[C@@H]1CC=C(/C=C/[Si](CC)(CC)CC)CC1
InChIInChI=1S/C17H30Si/c1-6-18(7-2,8-3)14-13-16-9-11-17(12-10-16)15(4)5/h9,13-14,17H,4,6-8,10-12H2,1-3,5H3/b14-13+/t17-/m1/s1
InChIKeyBBHPDSSTKFIWBI-TUQDCPSNSA-N
MW262.51 g/mol
LogP5.89
Rot. Bonds6

About triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane

triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane (PubChem CID 154701868) has the molecular formula C17H30Si and a molecular weight of 262.51 g/mol. Its IUPAC name is triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane.

Molecular Properties

Compound Nametriethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane
PubChem CID154701868
Molecular FormulaC17H30Si
Molecular Weight262.51 g/mol
Exact Mass262.21
IUPAC Nametriethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane
SMILESC=C(C)[C@@H]1CC=C(/C=C/[Si](CC)(CC)CC)CC1
InChIInChI=1S/C17H30Si/c1-6-18(7-2,8-3)14-13-16-9-11-17(12-10-16)15(4)5/h9,13-14,17H,4,6-8,10-12H2,1-3,5H3/b14-13+/t17-/m1/s1
InChIKeyBBHPDSSTKFIWBI-TUQDCPSNSA-N
XLogP5.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.51
LogP ≤ 55.89
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

(4R)-1-methyl-4-[(2E,4E)-6-methylhepta-2,4-dien-2-yl]cyclohexene
CID 13579866
(4R)-1-methyl-4-[(2E,4E)-6-methylhepta-2,4,6-trien-2-yl]cyclohexene
CID 24764079
(4R)-1-methyl-4-(6-methylhepta-2,4,6-trien-2-yl)cyclohexene
CID 162999964
[(E)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 11252579
[(Z)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 13215154
[(E)-2-(cyclohexen-1-yl)ethenyl]-trimethylsilane
CID 14175461
6-Butyl-1-methylcyclohexa-1,3-diene
CID 12599191
1,5-Diethyl-1,3-cyclohexadiene
CID 17901395
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
4-Isoprenyl-1-methyl-cyclohexene
CID 129868618

Frequently Asked Questions

What is the IUPAC name of triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane?
The IUPAC name of triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane (CID 154701868) is triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane.
What is the SMILES notation for triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane?
The canonical SMILES for triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane is C=C(C)[C@@H]1CC=C(/C=C/[Si](CC)(CC)CC)CC1.
What is the InChIKey of triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane?
The InChIKey is BBHPDSSTKFIWBI-TUQDCPSNSA-N. The full InChI is InChI=1S/C17H30Si/c1-6-18(7-2,8-3)14-13-16-9-11-17(12-10-16)15(4)5/h9,13-14,17H,4,6-8,10-12H2,1-3,5H3/b14-13+/t17-/m1/s1.
What are the key properties of triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane?
triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane has a molecular weight of 262.51 g/mol, XLogP of 5.89, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-2-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]ethenyl]silane is sourced from PubChem (CID 154701868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).