(2-Fluoroethyl)benzene

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Basic information

CAS: 458-87-7
Standard SMILES: FCCc1ccccc1
InChIKey: VEEYKGRLIXCNCZ-UHFFFAOYSA-N
Molecular formula: C8H9F
Average molar mass: 124.15 g/mol
Monoisotopic mass: 124.06882845

Names & identifiers

Preferred name: (2-Fluoroethyl)benzene
IUPAC: 2-fluoroethylbenzene

Names & synonyms

(2-fluoroethyl)benzene458-87-7DTXSID00963444RefChem:1049690DTXCID2013911952-Fluoro ethylbenzene2-fluoroethylbenzene50561-93-8NSC142235(2-Fluoro-ethyl)-benzeneBenzene, (2-fluoroethyl)-SCHEMBL128225

Show more names

SCHEMBL219760SCHEMBL989591SCHEMBL1533241SCHEMBL2139341SCHEMBL3169832SCHEMBL9556084SCHEMBL16207396VEEYKGRLIXCNCZ-UHFFFAOYSA-N

Database identifiers

CAS: 458-87-7、50561-93-8
PubChem CID: 285371
DTXSID: DTXSID00963444
Nikkaji: J647.647C

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 9
Formal charge: 0
Complexity: 65

Experimental & physicochemical properties

SpringerMaterials Properties19F nuclear magnetic resonance spectrum

Related reactions

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Compound notes

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