1,3,5-tris(2-fluoroethoxy)benzene

C12H15F3O3 — CID 22164154

IUPAC1,3,5-tris(2-fluoroethoxy)benzene
SMILESFCCOc1cc(OCCF)cc(OCCF)c1
InChIInChI=1S/C12H15F3O3/c13-1-4-16-10-7-11(17-5-2-14)9-12(8-10)18-6-3-15/h7-9H,1-6H2
InChIKeyOCZOKFGOZCDCEI-UHFFFAOYSA-N
MW264.24 g/mol
LogP2.73
Rot. Bonds9

About 1,3,5-tris(2-fluoroethoxy)benzene

1,3,5-tris(2-fluoroethoxy)benzene (PubChem CID 22164154) has the molecular formula C12H15F3O3 and a molecular weight of 264.24 g/mol. Its IUPAC name is 1,3,5-tris(2-fluoroethoxy)benzene.

Molecular Properties

Compound Name1,3,5-tris(2-fluoroethoxy)benzene
PubChem CID22164154
Molecular FormulaC12H15F3O3
Molecular Weight264.24 g/mol
Exact Mass264.10
IUPAC Name1,3,5-tris(2-fluoroethoxy)benzene
SMILESFCCOc1cc(OCCF)cc(OCCF)c1
InChIInChI=1S/C12H15F3O3/c13-1-4-16-10-7-11(17-5-2-14)9-12(8-10)18-6-3-15/h7-9H,1-6H2
InChIKeyOCZOKFGOZCDCEI-UHFFFAOYSA-N
XLogP2.73
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(2-fluoroethoxy)-5-methoxyphenyl]methanamine
CID 103566052
methyl 3,5-bis(2-fluoroethoxy)benzoate
CID 86609559
ethane;1-(2-fluoroethoxy)-4-methylbenzene
CID 142309231
2,3-dichloro-5-(2-fluoroethoxy)pyridine
CID 132590774
2,4-bis(2-fluoroethoxy)-1-methylbenzene
CID 15058706
3-(2-fluoroethoxy)-1H-pyrrole
CID 91585742
1,3,5-tributoxybenzene
CID 15933337
4-(2-fluoroethoxy)benzaldehyde
CID 15058649
2-[3-(2-fluoroethoxy)phenyl]ethanamine
CID 80693684
[3-(3-fluoropropoxy)-5-methoxyphenyl]methanamine
CID 103566053
2-[3-chloro-5-(2-hydroxyethoxy)phenoxy]ethanol
CID 54038432
4-(2-fluoroethoxy)benzenesulfinic acid
CID 123969802

Frequently Asked Questions

What is the IUPAC name of 1,3,5-tris(2-fluoroethoxy)benzene?
The IUPAC name of 1,3,5-tris(2-fluoroethoxy)benzene (CID 22164154) is 1,3,5-tris(2-fluoroethoxy)benzene.
What is the SMILES notation for 1,3,5-tris(2-fluoroethoxy)benzene?
The canonical SMILES for 1,3,5-tris(2-fluoroethoxy)benzene is FCCOc1cc(OCCF)cc(OCCF)c1.
What is the InChIKey of 1,3,5-tris(2-fluoroethoxy)benzene?
The InChIKey is OCZOKFGOZCDCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3O3/c13-1-4-16-10-7-11(17-5-2-14)9-12(8-10)18-6-3-15/h7-9H,1-6H2.
What are the key properties of 1,3,5-tris(2-fluoroethoxy)benzene?
1,3,5-tris(2-fluoroethoxy)benzene has a molecular weight of 264.24 g/mol, XLogP of 2.73, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-tris(2-fluoroethoxy)benzene is sourced from PubChem (CID 22164154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).