trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane

C13H26OSi — CID 11096320

IUPACtrimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane
SMILESCC(C)[C@@H]1CC[C@@H](C)C=C1O[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-10(2)12-8-7-11(3)9-13(12)14-15(4,5)6/h9-12H,7-8H2,1-6H3/t11-,12+/m1/s1
InChIKeyNWHSOZUHIDRDCH-NEPJUHHUSA-N
MW226.44 g/mol
LogP4.42
Rot. Bonds3

About trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane

trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane (PubChem CID 11096320) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane
PubChem CID11096320
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametrimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane
SMILESCC(C)[C@@H]1CC[C@@H](C)C=C1O[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-10(2)12-8-7-11(3)9-13(12)14-15(4,5)6/h9-12H,7-8H2,1-6H3/t11-,12+/m1/s1
InChIKeyNWHSOZUHIDRDCH-NEPJUHHUSA-N
XLogP4.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Bicyclo(2.2.1)hept-2-ene, 2-trimethylsiloxy-
CID 143502
Trimethyl-(3-methyl-cyclohex-1-enyloxy)-silane
CID 597981
Silane, [(3,3-dimethyl-1-cyclohexen-1-yl)oxy]trimethyl-
CID 602953
4-Tert-butyl-1-trimethylsilyloxy-1-cyclohexene
CID 10911276
Trimethyl[(6-methylcyclohex-1-en-1-yl)oxy]silane
CID 11063095
(3-Ethylcyclohexen-1-yl)oxy-trimethylsilane
CID 597987
(3-But-3-enylcyclopenten-1-yl)oxy-trimethylsilane
CID 10375839
Trimethyl-[3-(3-methylbut-3-enyl)cyclohexen-1-yl]oxysilane
CID 10490148
Trimethyl-[3-(4-methylpent-3-enyl)cyclohexen-1-yl]oxysilane
CID 10658496
(3-But-3-enylcyclohexen-1-yl)oxy-trimethylsilane
CID 11042390
[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
CID 11229389
4-Tert-butyl-1-cyclohexen-1-yl tert-butyl(dimethyl)silyl ether
CID 12439600

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane?
The IUPAC name of trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane (CID 11096320) is trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane.
What is the SMILES notation for trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane?
The canonical SMILES for trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane is CC(C)[C@@H]1CC[C@@H](C)C=C1O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane?
The InChIKey is NWHSOZUHIDRDCH-NEPJUHHUSA-N. The full InChI is InChI=1S/C13H26OSi/c1-10(2)12-8-7-11(3)9-13(12)14-15(4,5)6/h9-12H,7-8H2,1-6H3/t11-,12+/m1/s1.
What are the key properties of trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane?
trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane has a molecular weight of 226.44 g/mol, XLogP of 4.42, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane is sourced from PubChem (CID 11096320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).