ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane

C7H13F5OSi — CID 139667289

IUPACethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane
SMILESCC[Si](C)(C)OCC(F)(F)C(F)(F)F
InChIInChI=1S/C7H13F5OSi/c1-4-14(2,3)13-5-6(8,9)7(10,11)12/h4-5H2,1-3H3
InChIKeyKTACGIPBKYXBIT-UHFFFAOYSA-N
MW236.26 g/mol
LogP3.43
Rot. Bonds4

About ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane

ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane (PubChem CID 139667289) has the molecular formula C7H13F5OSi and a molecular weight of 236.26 g/mol. Its IUPAC name is ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane.

Molecular Properties

Compound Nameethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane
PubChem CID139667289
Molecular FormulaC7H13F5OSi
Molecular Weight236.26 g/mol
Exact Mass236.07
IUPAC Nameethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane
SMILESCC[Si](C)(C)OCC(F)(F)C(F)(F)F
InChIInChI=1S/C7H13F5OSi/c1-4-14(2,3)13-5-6(8,9)7(10,11)12/h4-5H2,1-3H3
InChIKeyKTACGIPBKYXBIT-UHFFFAOYSA-N
XLogP3.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane?
The IUPAC name of ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane (CID 139667289) is ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane.
What is the SMILES notation for ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane?
The canonical SMILES for ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane is CC[Si](C)(C)OCC(F)(F)C(F)(F)F.
What is the InChIKey of ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane?
The InChIKey is KTACGIPBKYXBIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F5OSi/c1-4-14(2,3)13-5-6(8,9)7(10,11)12/h4-5H2,1-3H3.
What are the key properties of ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane?
ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane has a molecular weight of 236.26 g/mol, XLogP of 3.43, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethyl-(2,2,3,3,3-pentafluoropropoxy)silane is sourced from PubChem (CID 139667289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).