1-chloro-2-ethoxy-4-fluorobenzene

C8H8ClFO — CID 2773702

IUPAC1-chloro-2-ethoxy-4-fluorobenzene
SMILESCCOc1cc(F)ccc1Cl
InChIInChI=1S/C8H8ClFO/c1-2-11-8-5-6(10)3-4-7(8)9/h3-5H,2H2,1H3
InChIKeyPRQZQYZDNHYNMM-UHFFFAOYSA-N
MW174.60 g/mol
LogP2.88
Rot. Bonds2

About 1-chloro-2-ethoxy-4-fluorobenzene

1-chloro-2-ethoxy-4-fluorobenzene (PubChem CID 2773702) has the molecular formula C8H8ClFO and a molecular weight of 174.60 g/mol. Its IUPAC name is 1-chloro-2-ethoxy-4-fluorobenzene.

Molecular Properties

Compound Name1-chloro-2-ethoxy-4-fluorobenzene
PubChem CID2773702
Molecular FormulaC8H8ClFO
Molecular Weight174.60 g/mol
Exact Mass174.02
IUPAC Name1-chloro-2-ethoxy-4-fluorobenzene
SMILESCCOc1cc(F)ccc1Cl
InChIInChI=1S/C8H8ClFO/c1-2-11-8-5-6(10)3-4-7(8)9/h3-5H,2H2,1H3
InChIKeyPRQZQYZDNHYNMM-UHFFFAOYSA-N
XLogP2.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.60
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-chloro-2-ethoxy-4-fluorobenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-chloro-4-fluoro-2-octoxybenzene
CID 114264358
1-chloro-2-(2,2-difluoroethoxy)-4-fluorobenzene
CID 130501614
2-(2-chloro-5-fluorophenoxy)acetonitrile
CID 91656530
1-chloro-4-fluoro-2-prop-2-ynoxybenzene
CID 22482803
2-(2-chloro-5-fluorophenoxy)-N-methylethanamine;hydrochloride
CID 146675459
1-chloro-4-fluoro-2-phenylmethoxybenzene
CID 91656120
ethane;1-ethoxy-2,4-difluorobenzene
CID 142043713
3-(2-chloro-5-fluorophenoxy)-N-ethyl-2,2-dimethylpropan-1-amine
CID 114264333
(2-chloro-5-fluorophenyl) hypoiodite
CID 145463596
(2R)-1-(2-chloro-5-fluorophenoxy)-3-propan-2-yloxypropan-2-ol
CID 124625807
CID 69055429
CID 69055429
1-amino-3-(2-chloro-5-fluorophenoxy)propan-2-ol
CID 66793811

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-ethoxy-4-fluorobenzene?
The IUPAC name of 1-chloro-2-ethoxy-4-fluorobenzene (CID 2773702) is 1-chloro-2-ethoxy-4-fluorobenzene.
What is the SMILES notation for 1-chloro-2-ethoxy-4-fluorobenzene?
The canonical SMILES for 1-chloro-2-ethoxy-4-fluorobenzene is CCOc1cc(F)ccc1Cl.
What is the InChIKey of 1-chloro-2-ethoxy-4-fluorobenzene?
The InChIKey is PRQZQYZDNHYNMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFO/c1-2-11-8-5-6(10)3-4-7(8)9/h3-5H,2H2,1H3.
What are the key properties of 1-chloro-2-ethoxy-4-fluorobenzene?
1-chloro-2-ethoxy-4-fluorobenzene has a molecular weight of 174.60 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-ethoxy-4-fluorobenzene is sourced from PubChem (CID 2773702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).