1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane

C22H40O2Si — CID 135079746

IUPAC1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane
SMILESC=CC(O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C)C1CCCCC1
InChIInChI=1S/C22H40O2Si/c1-8-14-21(15-9-2)23-25(18(4)5,19(6)7)24-22(10-3)20-16-12-11-13-17-20/h8-10,14-15,18-22H,3,11-13,16-17H2,1-2,4-7H3/b14-8+,15-9+
InChIKeyANWDVIYGWLORRS-VOMDNODZSA-N
MW364.65 g/mol
LogP6.94
Rot. Bonds10

About 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane

1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane (PubChem CID 135079746) has the molecular formula C22H40O2Si and a molecular weight of 364.65 g/mol. Its IUPAC name is 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane
PubChem CID135079746
Molecular FormulaC22H40O2Si
Molecular Weight364.65 g/mol
Exact Mass364.28
IUPAC Name1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane
SMILESC=CC(O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C)C1CCCCC1
InChIInChI=1S/C22H40O2Si/c1-8-14-21(15-9-2)23-25(18(4)5,19(6)7)24-22(10-3)20-16-12-11-13-17-20/h8-10,14-15,18-22H,3,11-13,16-17H2,1-2,4-7H3/b14-8+,15-9+
InChIKeyANWDVIYGWLORRS-VOMDNODZSA-N
XLogP6.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.65
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane?
The IUPAC name of 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane (CID 135079746) is 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane.
What is the SMILES notation for 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane?
The canonical SMILES for 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane is C=CC(O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C)C1CCCCC1.
What is the InChIKey of 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane?
The InChIKey is ANWDVIYGWLORRS-VOMDNODZSA-N. The full InChI is InChI=1S/C22H40O2Si/c1-8-14-21(15-9-2)23-25(18(4)5,19(6)7)24-22(10-3)20-16-12-11-13-17-20/h8-10,14-15,18-22H,3,11-13,16-17H2,1-2,4-7H3/b14-8+,15-9+.
What are the key properties of 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane?
1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane has a molecular weight of 364.65 g/mol, XLogP of 6.94, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexylprop-2-enoxy-[(2E,5E)-hepta-2,5-dien-4-yl]oxy-di(propan-2-yl)silane is sourced from PubChem (CID 135079746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).