chloro-cyclohexyloxy-bis(prop-2-enoxy)silane

C12H21ClO3Si — CID 121010910

IUPACchloro-cyclohexyloxy-bis(prop-2-enoxy)silane
SMILESC=CCO[Si](Cl)(OCC=C)OC1CCCCC1
InChIInChI=1S/C12H21ClO3Si/c1-3-10-14-17(13,15-11-4-2)16-12-8-6-5-7-9-12/h3-4,12H,1-2,5-11H2
InChIKeyXCXNLDOJCWDMEN-UHFFFAOYSA-N
MW276.84 g/mol
LogP3.42
Rot. Bonds8

About chloro-cyclohexyloxy-bis(prop-2-enoxy)silane

chloro-cyclohexyloxy-bis(prop-2-enoxy)silane (PubChem CID 121010910) has the molecular formula C12H21ClO3Si and a molecular weight of 276.84 g/mol. Its IUPAC name is chloro-cyclohexyloxy-bis(prop-2-enoxy)silane.

Molecular Properties

Compound Namechloro-cyclohexyloxy-bis(prop-2-enoxy)silane
PubChem CID121010910
Molecular FormulaC12H21ClO3Si
Molecular Weight276.84 g/mol
Exact Mass276.09
IUPAC Namechloro-cyclohexyloxy-bis(prop-2-enoxy)silane
SMILESC=CCO[Si](Cl)(OCC=C)OC1CCCCC1
InChIInChI=1S/C12H21ClO3Si/c1-3-10-14-17(13,15-11-4-2)16-12-8-6-5-7-9-12/h3-4,12H,1-2,5-11H2
InChIKeyXCXNLDOJCWDMEN-UHFFFAOYSA-N
XLogP3.42
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.84
LogP ≤ 53.42
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-cyclohexyloxy-bis(prop-2-enoxy)silane?
The IUPAC name of chloro-cyclohexyloxy-bis(prop-2-enoxy)silane (CID 121010910) is chloro-cyclohexyloxy-bis(prop-2-enoxy)silane.
What is the SMILES notation for chloro-cyclohexyloxy-bis(prop-2-enoxy)silane?
The canonical SMILES for chloro-cyclohexyloxy-bis(prop-2-enoxy)silane is C=CCO[Si](Cl)(OCC=C)OC1CCCCC1.
What is the InChIKey of chloro-cyclohexyloxy-bis(prop-2-enoxy)silane?
The InChIKey is XCXNLDOJCWDMEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21ClO3Si/c1-3-10-14-17(13,15-11-4-2)16-12-8-6-5-7-9-12/h3-4,12H,1-2,5-11H2.
What are the key properties of chloro-cyclohexyloxy-bis(prop-2-enoxy)silane?
chloro-cyclohexyloxy-bis(prop-2-enoxy)silane has a molecular weight of 276.84 g/mol, XLogP of 3.42, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-cyclohexyloxy-bis(prop-2-enoxy)silane is sourced from PubChem (CID 121010910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).