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

C12H15F3O3 — CID 15058725

IUPAC1,2,3-tris(2-fluoroethoxy)benzene
SMILESFCCOc1cccc(OCCF)c1OCCF
InChIInChI=1S/C12H15F3O3/c13-4-7-16-10-2-1-3-11(17-8-5-14)12(10)18-9-6-15/h1-3H,4-9H2
InChIKeySHAXYIKYESENCN-UHFFFAOYSA-N
MW264.24 g/mol
LogP2.73
Rot. Bonds9

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

1,2,3-tris(2-fluoroethoxy)benzene (PubChem CID 15058725) has the molecular formula C12H15F3O3 and a molecular weight of 264.24 g/mol. Its IUPAC name is 1,2,3-tris(2-fluoroethoxy)benzene.

Molecular Properties

Compound Name1,2,3-tris(2-fluoroethoxy)benzene
PubChem CID15058725
Molecular FormulaC12H15F3O3
Molecular Weight264.24 g/mol
Exact Mass264.10
IUPAC Name1,2,3-tris(2-fluoroethoxy)benzene
SMILESFCCOc1cccc(OCCF)c1OCCF
InChIInChI=1S/C12H15F3O3/c13-4-7-16-10-2-1-3-11(17-8-5-14)12(10)18-9-6-15/h1-3H,4-9H2
InChIKeySHAXYIKYESENCN-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

1,2-bis(2-fluoroethoxy)benzene
CID 15058677
2,3-bis(2-fluoroethoxy)benzaldehyde
CID 15058684
4-[2,3-bis(4-hydroxybutoxy)phenoxy]butan-1-ol
CID 135239341
3-chloro-2-(2-fluoroethoxy)aniline
CID 107715740
1,2,3-tridodecoxybenzene
CID 11308140
1,2,3-trihexadecoxybenzene
CID 15518170
1-(chloromethyl)-2-(2-fluoroethoxy)-3-methoxybenzene
CID 80695590
2-(2-fluoroethoxy)-3-methoxybenzaldehyde
CID 80693762
2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
CID 139797700
2-chloro-3-(2-fluoroethoxy)pyridine
CID 79035180
ethane;1-ethyl-2-(2-fluoroethoxy)benzene
CID 170716854
2-bromo-3-(2-fluoroethoxy)benzaldehyde
CID 170993640

Frequently Asked Questions

What is the IUPAC name of 1,2,3-tris(2-fluoroethoxy)benzene?
The IUPAC name of 1,2,3-tris(2-fluoroethoxy)benzene (CID 15058725) is 1,2,3-tris(2-fluoroethoxy)benzene.
What is the SMILES notation for 1,2,3-tris(2-fluoroethoxy)benzene?
The canonical SMILES for 1,2,3-tris(2-fluoroethoxy)benzene is FCCOc1cccc(OCCF)c1OCCF.
What is the InChIKey of 1,2,3-tris(2-fluoroethoxy)benzene?
The InChIKey is SHAXYIKYESENCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3O3/c13-4-7-16-10-2-1-3-11(17-8-5-14)12(10)18-9-6-15/h1-3H,4-9H2.
What are the key properties of 1,2,3-tris(2-fluoroethoxy)benzene?
1,2,3-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 1,2,3-tris(2-fluoroethoxy)benzene is sourced from PubChem (CID 15058725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).