1-chloro-4-ethyl-2-fluorobenzene

C8H8ClF — CID 18711819

IUPAC1-chloro-4-ethyl-2-fluorobenzene
SMILESCCc1ccc(Cl)c(F)c1
InChIInChI=1S/C8H8ClF/c1-2-6-3-4-7(9)8(10)5-6/h3-5H,2H2,1H3
InChIKeyHVNKCQJGKUGMID-UHFFFAOYSA-N
MW158.60 g/mol
LogP3.04
Rot. Bonds1

About 1-chloro-4-ethyl-2-fluorobenzene

1-chloro-4-ethyl-2-fluorobenzene (PubChem CID 18711819) has the molecular formula C8H8ClF and a molecular weight of 158.60 g/mol. Its IUPAC name is 1-chloro-4-ethyl-2-fluorobenzene.

Molecular Properties

Compound Name1-chloro-4-ethyl-2-fluorobenzene
PubChem CID18711819
Molecular FormulaC8H8ClF
Molecular Weight158.60 g/mol
Exact Mass158.03
IUPAC Name1-chloro-4-ethyl-2-fluorobenzene
SMILESCCc1ccc(Cl)c(F)c1
InChIInChI=1S/C8H8ClF/c1-2-6-3-4-7(9)8(10)5-6/h3-5H,2H2,1H3
InChIKeyHVNKCQJGKUGMID-UHFFFAOYSA-N
XLogP3.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.60
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-chloro-4-ethyl-2-fluorobenzene;ethane
CID 143692245
4-butyl-1-chloro-2-fluorobenzene
CID 20755408
1-chloro-4-[(3-ethylphenoxy)methyl]-2-fluorobenzene
CID 107888345
(4-chloro-3-fluorophenyl)methylazanium
CID 7015596
CID 59280137
CID 59280137
2-(4-chloro-3-fluorophenyl)-7-ethyl-9,10-dihydrophenanthrene
CID 139883517
2-(4-chloro-3-fluorophenyl)-5-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]pyrimidine
CID 20708859
2-(4-chloro-3-fluorophenyl)ethanethiol
CID 55275777
1-chloro-2-fluoro-4-methylbenzene;propane
CID 154658085
1-chloro-4-ethyl-2-methylbenzene;ethane
CID 142121320
1-chloro-4-(2-chloro-3-methylbutyl)-2-fluorobenzene
CID 130480157
4-chloro-N-[1-(4-ethylphenyl)ethyl]-3-fluoroaniline
CID 43721502

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-ethyl-2-fluorobenzene?
The IUPAC name of 1-chloro-4-ethyl-2-fluorobenzene (CID 18711819) is 1-chloro-4-ethyl-2-fluorobenzene.
What is the SMILES notation for 1-chloro-4-ethyl-2-fluorobenzene?
The canonical SMILES for 1-chloro-4-ethyl-2-fluorobenzene is CCc1ccc(Cl)c(F)c1.
What is the InChIKey of 1-chloro-4-ethyl-2-fluorobenzene?
The InChIKey is HVNKCQJGKUGMID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClF/c1-2-6-3-4-7(9)8(10)5-6/h3-5H,2H2,1H3.
What are the key properties of 1-chloro-4-ethyl-2-fluorobenzene?
1-chloro-4-ethyl-2-fluorobenzene has a molecular weight of 158.60 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-ethyl-2-fluorobenzene is sourced from PubChem (CID 18711819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).