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CAS Number: 33904-03-9
1-isothiocyanato-2,4-dimethoxybenzene

Structure

1-isothiocyanato-2,4-dimethoxybenzene
Name: 1-isothiocyanato-2,4-dimethoxybenzene
Synonyms:
General Information
Product Number: 33904039

CAS Registry Number 33904-03-9
Name:
Benzene, 1-?isothiocyanato-?2,?4-?dimethoxy-
1-Isothiocyanato-2,4-dimethoxybenzene
2,4-Dimethoxyphenyl isothiocyanate

 

Chemical Formula: C9H9NO2S
Exact Mass: 195.04
Molecular Weight: 195.24
m/z: 195.04 (100.0%), 196.04 (9.9%), 197.03 (4.5%), 196.03 (1.2%)

 

InChI:InChI=1S/C9H9NO2S/c1-11-7-3-4-8(10-6-13)9(5-7)12-2/h3-5H,1-2H3

InChI Key:CNXSCEPTSXPBTP-UHFFFAOYSA-N

Canonical SMILES:COC1=CC(=C(C=C1)N=C=S)OC

Specification

98%

References

PCT Int. Appl. (2015), WO 2015009742 A2 20150122.

PCT Int. Appl. (2014), WO 2014001204 A1 20140103.                                 

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