cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane

C14H17F5OSi — CID 523438

IUPACcyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane
SMILESC[Si](C)(OC1CCCCC1)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C14H17F5OSi/c1-21(2,20-8-6-4-3-5-7-8)14-12(18)10(16)9(15)11(17)13(14)19/h8H,3-7H2,1-2H3
InChIKeyDCLXQYASBSMZBL-UHFFFAOYSA-N
MW324.37 g/mol
LogP4.14
Rot. Bonds3

About cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane

cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 523438) has the molecular formula C14H17F5OSi and a molecular weight of 324.37 g/mol. Its IUPAC name is cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namecyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID523438
Molecular FormulaC14H17F5OSi
Molecular Weight324.37 g/mol
Exact Mass324.10
IUPAC Namecyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane
SMILESC[Si](C)(OC1CCCCC1)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C14H17F5OSi/c1-21(2,20-8-6-4-3-5-7-8)14-12(18)10(16)9(15)11(17)13(14)19/h8H,3-7H2,1-2H3
InChIKeyDCLXQYASBSMZBL-UHFFFAOYSA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane (CID 523438) is cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane is C[Si](C)(OC1CCCCC1)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is DCLXQYASBSMZBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F5OSi/c1-21(2,20-8-6-4-3-5-7-8)14-12(18)10(16)9(15)11(17)13(14)19/h8H,3-7H2,1-2H3.
What are the key properties of cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane?
cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 324.37 g/mol, XLogP of 4.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxy-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 523438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).