1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene

C15H14ClFO — CID 22164157

IUPAC1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene
SMILESFCCOC(c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C15H14ClFO/c16-14-9-5-4-8-13(14)15(18-11-10-17)12-6-2-1-3-7-12/h1-9,15H,10-11H2
InChIKeyJUDYIFKEELCLJH-UHFFFAOYSA-N
MW264.73 g/mol
LogP4.42
Rot. Bonds5

About 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene

1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene (PubChem CID 22164157) has the molecular formula C15H14ClFO and a molecular weight of 264.73 g/mol. Its IUPAC name is 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene.

Molecular Properties

Compound Name1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene
PubChem CID22164157
Molecular FormulaC15H14ClFO
Molecular Weight264.73 g/mol
Exact Mass264.07
IUPAC Name1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene
SMILESFCCOC(c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C15H14ClFO/c16-14-9-5-4-8-13(14)15(18-11-10-17)12-6-2-1-3-7-12/h1-9,15H,10-11H2
InChIKeyJUDYIFKEELCLJH-UHFFFAOYSA-N
XLogP4.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.73
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-Chlorostyrene oxide
CID 197010
Ether, bis(2,6-dichlorobenzyl)
CID 52735
2-(3-Chlorophenyl)oxirane
CID 155613
2-Chlorobenzhydrol, (+-)-
CID 235819
4-Chlorostilbene oxide
CID 608511
Bis(p-chlorobenzyl) ether
CID 41869
2-(2-Chlorophenyl)oxirane
CID 560709
(R)-(+)-3-Chlorostyrene oxide
CID 10898919
(2R)-2-(2-chlorophenyl)oxirane
CID 12035191
(2S)-2-(2-chlorophenyl)oxirane
CID 12561900
1,3-Dichloro-2-(methoxymethyl)benzene
CID 118490
1,1'-Biphenyl, 2-chloro-4'-(methoxymethyl)-
CID 3066107

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene?
The IUPAC name of 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene (CID 22164157) is 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene.
What is the SMILES notation for 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene?
The canonical SMILES for 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene is FCCOC(c1ccccc1)c1ccccc1Cl.
What is the InChIKey of 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene?
The InChIKey is JUDYIFKEELCLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO/c16-14-9-5-4-8-13(14)15(18-11-10-17)12-6-2-1-3-7-12/h1-9,15H,10-11H2.
What are the key properties of 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene?
1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene has a molecular weight of 264.73 g/mol, XLogP of 4.42, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[2-fluoroethoxy(phenyl)methyl]benzene is sourced from PubChem (CID 22164157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).