2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane

C18H34OSi — CID 10935296

IUPAC2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane
SMILESC=C1C=C[C@H]([C@H](C)CO[Si](C)(C)C(C)(C)C(C)C)CC1
InChIInChI=1S/C18H34OSi/c1-14(2)18(5,6)20(7,8)19-13-16(4)17-11-9-15(3)10-12-17/h9,11,14,16-17H,3,10,12-13H2,1-2,4-8H3/t16-,17+/m1/s1
InChIKeyJXHXRGQZLDPUJI-SJORKVTESA-N
MW294.56 g/mol
LogP5.80
Rot. Bonds6

About 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane

2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane (PubChem CID 10935296) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane
PubChem CID10935296
Molecular FormulaC18H34OSi
Molecular Weight294.56 g/mol
Exact Mass294.24
IUPAC Name2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane
SMILESC=C1C=C[C@H]([C@H](C)CO[Si](C)(C)C(C)(C)C(C)C)CC1
InChIInChI=1S/C18H34OSi/c1-14(2)18(5,6)20(7,8)19-13-16(4)17-11-9-15(3)10-12-17/h9,11,14,16-17H,3,10,12-13H2,1-2,4-8H3/t16-,17+/m1/s1
InChIKeyJXHXRGQZLDPUJI-SJORKVTESA-N
XLogP5.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.56
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane with MolForge

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Related Compounds

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beta-Citronellol, TBDMS derivative
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3,7-Dimethyloct-6-enoxy(triethyl)silane
CID 72751260
[(3aS,7aR)-1-methylidene-3,7a-dihydro-2H-inden-3a-yl]methoxy-tert-butyl-dimethylsilane
CID 11097819
[(2E,12R,13S)-13-bicyclo[10.2.1]pentadeca-1(15),2-dienyl]oxy-tert-butyl-dimethylsilane
CID 11302087
Tert-butyl-(8-cyclohex-3-en-1-yloctoxy)-dimethylsilane
CID 11313354
Tert-butyl(dimethyl)silyl (3R)-3,7-dimethyl-6-octenyl ether
CID 14336178
tert-butyl-[[(1R)-3-ethenylcyclohex-3-en-1-yl]methoxy]-dimethylsilane
CID 16220312
Tert-butyl-[[6-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-2-en-1-yl]cyclohexen-1-yl]methoxy]-dimethylsilane
CID 102475884
Tert-butyl-[(6-ethenylcyclohexen-1-yl)methoxy]-dimethylsilane
CID 102475885
t-Butyldimethyl{[(1r,2r,6r)-2-methyl-6-vinylcyclohex-3-en-1-yl]methoxy}silane
CID 129758377
[(1S,2S)-2-[(1E)-buta-1,3-dienyl]cyclohexyl]methoxy-tert-butyl-dimethylsilane
CID 134855624

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane?
The IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane (CID 10935296) is 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane?
The canonical SMILES for 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane is C=C1C=C[C@H]([C@H](C)CO[Si](C)(C)C(C)(C)C(C)C)CC1.
What is the InChIKey of 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane?
The InChIKey is JXHXRGQZLDPUJI-SJORKVTESA-N. The full InChI is InChI=1S/C18H34OSi/c1-14(2)18(5,6)20(7,8)19-13-16(4)17-11-9-15(3)10-12-17/h9,11,14,16-17H,3,10,12-13H2,1-2,4-8H3/t16-,17+/m1/s1.
What are the key properties of 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane?
2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane has a molecular weight of 294.56 g/mol, XLogP of 5.80, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl-dimethyl-[(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propoxy]silane is sourced from PubChem (CID 10935296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).