4-chloro-6-fluoro-1-benzofuran

C8H4ClFO — CID 130062962

IUPAC4-chloro-6-fluoro-1-benzofuran
SMILESFc1cc(Cl)c2ccoc2c1
InChIInChI=1S/C8H4ClFO/c9-7-3-5(10)4-8-6(7)1-2-11-8/h1-4H
InChIKeyCWWLPWBTLPJFBU-UHFFFAOYSA-N
MW170.57 g/mol
LogP3.23
Rot. Bonds

About 4-chloro-6-fluoro-1-benzofuran

4-chloro-6-fluoro-1-benzofuran (PubChem CID 130062962) has the molecular formula C8H4ClFO and a molecular weight of 170.57 g/mol. Its IUPAC name is 4-chloro-6-fluoro-1-benzofuran.

Molecular Properties

Compound Name4-chloro-6-fluoro-1-benzofuran
PubChem CID130062962
Molecular FormulaC8H4ClFO
Molecular Weight170.57 g/mol
Exact Mass169.99
IUPAC Name4-chloro-6-fluoro-1-benzofuran
SMILESFc1cc(Cl)c2ccoc2c1
InChIInChI=1S/C8H4ClFO/c9-7-3-5(10)4-8-6(7)1-2-11-8/h1-4H
InChIKeyCWWLPWBTLPJFBU-UHFFFAOYSA-N
XLogP3.23
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.57
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-fluoro-4-methyl-1-benzofuran
CID 66806743
4-chloro-6-methyl-1-benzofuran
CID 130062929
8-fluorobenzo[e][1]benzofuran
CID 101247142
4-chlorobenzo[g][1]benzofuran
CID 176753824
4,6-dichlorofuro[2,3-b]pyridine
CID 122129719
7-bromo-4,6-dichloro-1-benzofuran
CID 22144862
8-bromo-6-fluorochromen-4-one
CID 83396930
7-bromo-4-chlorobenzo[f][1]benzofuran
CID 176753869
4-(3-fluorophenyl)-1-benzofuran
CID 10751013
2,6-dichloro-4-fluorobenzenethiol
CID 50998605
4-methylfuro[3,2-e][1]benzofuran
CID 170151915
chromen-4-one;fluorobenzene
CID 174960592

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-fluoro-1-benzofuran?
The IUPAC name of 4-chloro-6-fluoro-1-benzofuran (CID 130062962) is 4-chloro-6-fluoro-1-benzofuran.
What is the SMILES notation for 4-chloro-6-fluoro-1-benzofuran?
The canonical SMILES for 4-chloro-6-fluoro-1-benzofuran is Fc1cc(Cl)c2ccoc2c1.
What is the InChIKey of 4-chloro-6-fluoro-1-benzofuran?
The InChIKey is CWWLPWBTLPJFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4ClFO/c9-7-3-5(10)4-8-6(7)1-2-11-8/h1-4H.
What are the key properties of 4-chloro-6-fluoro-1-benzofuran?
4-chloro-6-fluoro-1-benzofuran has a molecular weight of 170.57 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-fluoro-1-benzofuran is sourced from PubChem (CID 130062962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).