dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane

C10H5Cl2F7OSi — CID 23523553

IUPACdichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
SMILESCCO[Si](Cl)(Cl)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F
InChIInChI=1S/C10H5Cl2F7OSi/c1-2-20-21(11,12)9-7(16)4(13)3(5(14)8(9)17)6(15)10(18)19/h2H2,1H3
InChIKeyRLVSMXLTKZVXFA-UHFFFAOYSA-N
MW373.13 g/mol
LogP4.44
Rot. Bonds4

About dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane

dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane (PubChem CID 23523553) has the molecular formula C10H5Cl2F7OSi and a molecular weight of 373.13 g/mol. Its IUPAC name is dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane.

Molecular Properties

Compound Namedichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
PubChem CID23523553
Molecular FormulaC10H5Cl2F7OSi
Molecular Weight373.13 g/mol
Exact Mass371.94
IUPAC Namedichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
SMILESCCO[Si](Cl)(Cl)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F
InChIInChI=1S/C10H5Cl2F7OSi/c1-2-20-21(11,12)9-7(16)4(13)3(5(14)8(9)17)6(15)10(18)19/h2H2,1H3
InChIKeyRLVSMXLTKZVXFA-UHFFFAOYSA-N
XLogP4.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.13
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The IUPAC name of dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane (CID 23523553) is dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane.
What is the SMILES notation for dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The canonical SMILES for dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane is CCO[Si](Cl)(Cl)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F.
What is the InChIKey of dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The InChIKey is RLVSMXLTKZVXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2F7OSi/c1-2-20-21(11,12)9-7(16)4(13)3(5(14)8(9)17)6(15)10(18)19/h2H2,1H3.
What are the key properties of dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane has a molecular weight of 373.13 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-ethoxy-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane is sourced from PubChem (CID 23523553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).