Basic information
- CAS
122855-66-7- Standard SMILES
Cn1cc2ccccc2c1N1C=NC(F)=NC1F- InChIKey
MFYLOZZDOMQETI-UHFFFAOYSA-N- Molecular formula
- C12H10F2N4
- Average molar mass
- 248.23 g/mol
- Monoisotopic mass
- 248.08735266
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-(4,6-Difluoro-1,3,5-triazinyl)-2-methylisoindole
- IUPAC
- 1-(2,4-difluoro-2H-1,3,5-triazin-1-yl)-2-methylisoindole
- English name
- 1-(4,6-difluoro-1,3,5-triazinyl)-2-methylisoindole
- Molecular weight
- 0
Names & synonyms
1-Dftmi1-(4,6-Difluoro-1,3,5-triazinyl)-2-methylisoindoleRefChem:74370122855-66-71-(2,4-difluoro-2H-1,3,5-triazin-1-yl)-2-methylisoindoleDTXSID409242961-(2,4-difluoro-1,3,5-triazin-1(2H)-yl)-2-methyl-2H-isoindole1-(4,6-Difluoro-1,3,5-triazin-2-yl)-2-methyl-2H-isoindole
Database identifiers
- CAS
122855-66-7- PubChem CID
- 129779
- DTXSID
DTXSID40924296
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 32.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 384
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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