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CAS Number: 182565-27-1
1-fluoro-4-(1-isothiocyanatoethyl)benzene

Structure

1-fluoro-4-(1-isothiocyanatoethyl)benzene
Name: 1-fluoro-4-(1-isothiocyanatoethyl)benzene
Synonyms:
General Information
Product Number: 182565271

CAS Registry Number 182565-27-1
Name:
Benzene, 1-​fluoro-​4-​(1-​isothiocyanatoethyl)​-
1-(4-Fluorophenyl)ethyl isothiocyanate

 

Chemical Formula: C9H8FNS
Exact Mass: 181.04
Molecular Weight: 181.23
m/z: 181.04 (100.0%), 182.04 (10.6%), 183.03 (4.5%)

 

InChI:InChI=1S/C9H8FNS/c1-7(11-6-12)8-2-4-9(10)5-3-8/h2-5,7H,1H3

InChI Key:JXMBAXGHCKMDES-UHFFFAOYSA-N

Canonical SMILES:CC(C1=CC=C(C=C1)F)N=C=S

Specification

98%

References

PCT Int. Appl. (2009), WO 2009020580 A1 20090212.                                  

PCT Int. Appl. (2006), WO 2006122770 A1 20061123.                                 

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