Basic information
- CAS
50561-90-5- Standard SMILES
Cc1cccc(CCF)c1- InChIKey
UKWCATGJYJSBPR-UHFFFAOYSA-N- Molecular formula
- C9H11F
- Average molar mass
- 138.18 g/mol
- Monoisotopic mass
- 138.08447851
Names & identifiers
- Preferred name
- 1-(2-Fluoroethyl)-3-methylbenzene
- IUPAC
- 1-(2-fluoroethyl)-3-methylbenzene
Names & synonyms
50561-90-51-(2-fluoroethyl)-3-methylbenzeneNSC142246Benzene,1-(2-fluoroethyl)-3-methyl-SCHEMBL1533528SCHEMBL27288936DTXSID30301299NSC-142246DS-009961
Database identifiers
- CAS
50561-90-5- PubChem CID
- 285381
- DTXSID
DTXSID30301299
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 90.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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