trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane

C7H13F3OSi — CID 87523080

IUPACtrifluoro-[3-(2-methylprop-2-enoxy)propyl]silane
SMILESC=C(C)COCCC[Si](F)(F)F
InChIInChI=1S/C7H13F3OSi/c1-7(2)6-11-4-3-5-12(8,9)10/h1,3-6H2,2H3
InChIKeySPUHDDCNVDAPJM-UHFFFAOYSA-N
MW198.26 g/mol
LogP2.82
Rot. Bonds6

About trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane

trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane (PubChem CID 87523080) has the molecular formula C7H13F3OSi and a molecular weight of 198.26 g/mol. Its IUPAC name is trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane.

Molecular Properties

Compound Nametrifluoro-[3-(2-methylprop-2-enoxy)propyl]silane
PubChem CID87523080
Molecular FormulaC7H13F3OSi
Molecular Weight198.26 g/mol
Exact Mass198.07
IUPAC Nametrifluoro-[3-(2-methylprop-2-enoxy)propyl]silane
SMILESC=C(C)COCCC[Si](F)(F)F
InChIInChI=1S/C7H13F3OSi/c1-7(2)6-11-4-3-5-12(8,9)10/h1,3-6H2,2H3
InChIKeySPUHDDCNVDAPJM-UHFFFAOYSA-N
XLogP2.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane?
The IUPAC name of trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane (CID 87523080) is trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane.
What is the SMILES notation for trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane?
The canonical SMILES for trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane is C=C(C)COCCC[Si](F)(F)F.
What is the InChIKey of trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane?
The InChIKey is SPUHDDCNVDAPJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F3OSi/c1-7(2)6-11-4-3-5-12(8,9)10/h1,3-6H2,2H3.
What are the key properties of trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane?
trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane has a molecular weight of 198.26 g/mol, XLogP of 2.82, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro-[3-(2-methylprop-2-enoxy)propyl]silane is sourced from PubChem (CID 87523080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).