7-chloro-6-fluoro-2,4-dimethylindazole

C9H8ClFN2 — CID 166076486

IUPAC7-chloro-6-fluoro-2,4-dimethylindazole
SMILESCc1cc(F)c(Cl)c2nn(C)cc12
InChIInChI=1S/C9H8ClFN2/c1-5-3-7(11)8(10)9-6(5)4-13(2)12-9/h3-4H,1-2H3
InChIKeyLGPGCHSQERDXQR-UHFFFAOYSA-N
MW198.63 g/mol
LogP2.67
Rot. Bonds

About 7-chloro-6-fluoro-2,4-dimethylindazole

7-chloro-6-fluoro-2,4-dimethylindazole (PubChem CID 166076486) has the molecular formula C9H8ClFN2 and a molecular weight of 198.63 g/mol. Its IUPAC name is 7-chloro-6-fluoro-2,4-dimethylindazole.

Molecular Properties

Compound Name7-chloro-6-fluoro-2,4-dimethylindazole
PubChem CID166076486
Molecular FormulaC9H8ClFN2
Molecular Weight198.63 g/mol
Exact Mass198.04
IUPAC Name7-chloro-6-fluoro-2,4-dimethylindazole
SMILESCc1cc(F)c(Cl)c2nn(C)cc12
InChIInChI=1S/C9H8ClFN2/c1-5-3-7(11)8(10)9-6(5)4-13(2)12-9/h3-4H,1-2H3
InChIKeyLGPGCHSQERDXQR-UHFFFAOYSA-N
XLogP2.67
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.63
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6,7-difluoro-2,4-dimethylindazole
CID 166076527
7-chloro-6-fluoro-2-methyl-4-propan-2-ylindazole
CID 175616665
5-bromo-4-fluoro-2,7-dimethylindazole;ethane
CID 178051017
3-(2-chloro-3-fluoro-6-methoxy-5-methylphenyl)-1-methylpyrazol-5-amine
CID 117427225
4-(3,5-difluoro-4-methylphenyl)-2,7-dimethylindazole
CID 166076690
ethane;7-fluoro-2,5-dimethylindazole;2,5,7-trimethylindazole
CID 156888629
7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole
CID 166076510
2-chloro-6-(2,7-dimethylindazol-5-yl)-8-fluoroquinoline
CID 142492191
6-chloro-2,5-dimethylindazole
CID 171662405
5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine
CID 162432890
6-chloro-7-fluoro-2-methylindazole
CID 171662432
4,6-difluoro-2-methylindazole-5-carbaldehyde
CID 162382115

Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-fluoro-2,4-dimethylindazole?
The IUPAC name of 7-chloro-6-fluoro-2,4-dimethylindazole (CID 166076486) is 7-chloro-6-fluoro-2,4-dimethylindazole.
What is the SMILES notation for 7-chloro-6-fluoro-2,4-dimethylindazole?
The canonical SMILES for 7-chloro-6-fluoro-2,4-dimethylindazole is Cc1cc(F)c(Cl)c2nn(C)cc12.
What is the InChIKey of 7-chloro-6-fluoro-2,4-dimethylindazole?
The InChIKey is LGPGCHSQERDXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClFN2/c1-5-3-7(11)8(10)9-6(5)4-13(2)12-9/h3-4H,1-2H3.
What are the key properties of 7-chloro-6-fluoro-2,4-dimethylindazole?
7-chloro-6-fluoro-2,4-dimethylindazole has a molecular weight of 198.63 g/mol, XLogP of 2.67, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-fluoro-2,4-dimethylindazole is sourced from PubChem (CID 166076486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).