Basic information
- CAS
53542-37-3- Standard SMILES
O=c1c2ccc(F)cc2sc2ccc(C(F)(F)F)cc12- InChIKey
ZDGGCIXEWFPFAH-UHFFFAOYSA-N- Molecular formula
- C14H6F4OS
- Average molar mass
- 298.26 g/mol
- Monoisotopic mass
- 298.00754863
Names & identifiers
- Preferred name
- 6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-one
- IUPAC
- 6-fluoro-2-(trifluoromethyl)thioxanthen-9-one
- English name
- 6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-one
- Molecular formula
- C14H6F4OS
- Molecular weight
- 298.26
Names & synonyms
6-Fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-one53542-37-3EINECS 258-618-3DTXSID30968301RefChem:104626DTXCID401395886258-618-36-fluoro-2-(trifluoromethyl)thioxanthen-9-oneSCHEMBL11158985DB-325523NS000577259H-Thioxanthen-9-one, 6-fluoro-2-(trifluoromethyl)-
Database identifiers
- CAS
53542-37-3- PubChem CID
- 104530
- DTXSID
DTXSID30968301- EC Number
- 258-618-3
- Nikkaji
- J295.989E
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 397
Chemistry & industry
Suppliers3 total
苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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