4-chloro-5-fluoro-1H-indol-2-ol

C8H5ClFNO — CID 57263586

IUPAC4-chloro-5-fluoro-1H-indol-2-ol
SMILESOc1cc2c(Cl)c(F)ccc2[nH]1
InChIInChI=1S/C8H5ClFNO/c9-8-4-3-7(12)11-6(4)2-1-5(8)10/h1-3,11-12H
InChIKeyORZANJDVVOFCBY-UHFFFAOYSA-N
MW185.58 g/mol
LogP2.67
Rot. Bonds

About 4-chloro-5-fluoro-1H-indol-2-ol

4-chloro-5-fluoro-1H-indol-2-ol (PubChem CID 57263586) has the molecular formula C8H5ClFNO and a molecular weight of 185.58 g/mol. Its IUPAC name is 4-chloro-5-fluoro-1H-indol-2-ol.

Molecular Properties

Compound Name4-chloro-5-fluoro-1H-indol-2-ol
PubChem CID57263586
Molecular FormulaC8H5ClFNO
Molecular Weight185.58 g/mol
Exact Mass185.00
IUPAC Name4-chloro-5-fluoro-1H-indol-2-ol
SMILESOc1cc2c(Cl)c(F)ccc2[nH]1
InChIInChI=1S/C8H5ClFNO/c9-8-4-3-7(12)11-6(4)2-1-5(8)10/h1-3,11-12H
InChIKeyORZANJDVVOFCBY-UHFFFAOYSA-N
XLogP2.67
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.58
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-fluoro-1H-indol-2-ol?
The IUPAC name of 4-chloro-5-fluoro-1H-indol-2-ol (CID 57263586) is 4-chloro-5-fluoro-1H-indol-2-ol.
What is the SMILES notation for 4-chloro-5-fluoro-1H-indol-2-ol?
The canonical SMILES for 4-chloro-5-fluoro-1H-indol-2-ol is Oc1cc2c(Cl)c(F)ccc2[nH]1.
What is the InChIKey of 4-chloro-5-fluoro-1H-indol-2-ol?
The InChIKey is ORZANJDVVOFCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClFNO/c9-8-4-3-7(12)11-6(4)2-1-5(8)10/h1-3,11-12H.
What are the key properties of 4-chloro-5-fluoro-1H-indol-2-ol?
4-chloro-5-fluoro-1H-indol-2-ol has a molecular weight of 185.58 g/mol, XLogP of 2.67, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-fluoro-1H-indol-2-ol is sourced from PubChem (CID 57263586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).