1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene

C20H16ClF — CID 57309046

IUPAC1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene
SMILESFc1ccc(-c2ccc(CCc3ccccc3Cl)cc2)cc1
InChIInChI=1S/C20H16ClF/c21-20-4-2-1-3-18(20)10-7-15-5-8-16(9-6-15)17-11-13-19(22)14-12-17/h1-6,8-9,11-14H,7,10H2
InChIKeyYDCBFEOYUWREQG-UHFFFAOYSA-N
MW310.80 g/mol
LogP5.93
Rot. Bonds4

About 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene

1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene (PubChem CID 57309046) has the molecular formula C20H16ClF and a molecular weight of 310.80 g/mol. Its IUPAC name is 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene.

Molecular Properties

Compound Name1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene
PubChem CID57309046
Molecular FormulaC20H16ClF
Molecular Weight310.80 g/mol
Exact Mass310.09
IUPAC Name1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene
SMILESFc1ccc(-c2ccc(CCc3ccccc3Cl)cc2)cc1
InChIInChI=1S/C20H16ClF/c21-20-4-2-1-3-18(20)10-7-15-5-8-16(9-6-15)17-11-13-19(22)14-12-17/h1-6,8-9,11-14H,7,10H2
InChIKeyYDCBFEOYUWREQG-UHFFFAOYSA-N
XLogP5.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.80
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-Chlorobiphenyl
CID 249266
2,2'-Dichlorobiphenyl
CID 25622
(2-Chlorophenyl)diphenylmethane
CID 14347913
2-Chlorotrityl chloride
CID 94524
Tris(4-chlorophenyl)methane
CID 92256
4-(4-Ethylphenyl)-2-fluoro-1-(4-propylphenyl)benzene
CID 1715558
Benzene, 1-chloro-2-(phenylmethyl)-
CID 123431
5,11-Dichlorotricyclo(8.2.2.24,7)hexadeca-4,6,10,12,13,15-hexaene
CID 11065727
4-Chloro-4''-methyl-1,1':4',1''-terphenyl
CID 23391118
2'-Fluoro-4-pentyl-4''-propyl-1,1':4',1''-terphenyl
CID 17977863
1-(4-Ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene
CID 20719160
4''-Ethyl-2'-fluoro-4-pentyl-1,1':4',1''-terphenyl
CID 44828777

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene?
The IUPAC name of 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene (CID 57309046) is 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene.
What is the SMILES notation for 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene?
The canonical SMILES for 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene is Fc1ccc(-c2ccc(CCc3ccccc3Cl)cc2)cc1.
What is the InChIKey of 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene?
The InChIKey is YDCBFEOYUWREQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClF/c21-20-4-2-1-3-18(20)10-7-15-5-8-16(9-6-15)17-11-13-19(22)14-12-17/h1-6,8-9,11-14H,7,10H2.
What are the key properties of 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene?
1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene has a molecular weight of 310.80 g/mol, XLogP of 5.93, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[2-[4-(4-fluorophenyl)phenyl]ethyl]benzene is sourced from PubChem (CID 57309046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).