methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane

C22H40O3Si — CID 134822027

IUPACmethoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane
SMILESC=C(C)C1CCC(C)CC1O[Si](C)(OC)O[C@@H]1C[C@@H](C)CC[C@@H]1C(=C)C
InChIInChI=1S/C22H40O3Si/c1-15(2)19-11-9-17(5)13-21(19)24-26(8,23-7)25-22-14-18(6)10-12-20(22)16(3)4/h17-22H,1,3,9-14H2,2,4-8H3/t17-,18?,19+,20?,21+,22?,26?/m0/s1
InChIKeyRWXQFEHCMFPGMB-DJCKWCTKSA-N
MW380.65 g/mol
LogP6.00
Rot. Bonds7

About methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane

methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane (PubChem CID 134822027) has the molecular formula C22H40O3Si and a molecular weight of 380.65 g/mol. Its IUPAC name is methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane.

Molecular Properties

Compound Namemethoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane
PubChem CID134822027
Molecular FormulaC22H40O3Si
Molecular Weight380.65 g/mol
Exact Mass380.27
IUPAC Namemethoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane
SMILESC=C(C)C1CCC(C)CC1O[Si](C)(OC)O[C@@H]1C[C@@H](C)CC[C@@H]1C(=C)C
InChIInChI=1S/C22H40O3Si/c1-15(2)19-11-9-17(5)13-21(19)24-26(8,23-7)25-22-14-18(6)10-12-20(22)16(3)4/h17-22H,1,3,9-14H2,2,4-8H3/t17-,18?,19+,20?,21+,22?,26?/m0/s1
InChIKeyRWXQFEHCMFPGMB-DJCKWCTKSA-N
XLogP6.00
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.65
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane?
The IUPAC name of methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane (CID 134822027) is methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane.
What is the SMILES notation for methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane?
The canonical SMILES for methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane is C=C(C)C1CCC(C)CC1O[Si](C)(OC)O[C@@H]1C[C@@H](C)CC[C@@H]1C(=C)C.
What is the InChIKey of methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane?
The InChIKey is RWXQFEHCMFPGMB-DJCKWCTKSA-N. The full InChI is InChI=1S/C22H40O3Si/c1-15(2)19-11-9-17(5)13-21(19)24-26(8,23-7)25-22-14-18(6)10-12-20(22)16(3)4/h17-22H,1,3,9-14H2,2,4-8H3/t17-,18?,19+,20?,21+,22?,26?/m0/s1.
What are the key properties of methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane?
methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane has a molecular weight of 380.65 g/mol, XLogP of 6.00, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-methyl-[(1R,2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexyl]oxy-(5-methyl-2-prop-1-en-2-ylcyclohexyl)oxysilane is sourced from PubChem (CID 134822027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).