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Specification
The molecular formula of 3,5-Dimethoxyphenyl isothiocyanate is C9H9NO2S.
The molecular weight of 3,5-Dimethoxyphenyl isothiocyanate is 195.24 g/mol.
The IUPAC name of 3,5-Dimethoxyphenyl isothiocyanate is 1-isothiocyanato-3,5-dimethoxybenzene.
The InChI of 3,5-Dimethoxyphenyl isothiocyanate is InChI=1S/C9H9NO2S/c1-11-8-3-7(10-6-13)4-9(5-8)12-2/h3-5H,1-2H3.
The InChIKey of 3,5-Dimethoxyphenyl isothiocyanate is FKUHOOASBHTEQY-UHFFFAOYSA-N.
The CAS number of 3,5-Dimethoxyphenyl isothiocyanate is 104968-58-3.
The European Community Number of 3,5-Dimethoxyphenyl isothiocyanate is 641-281-5.
The XLogP3-AA value of 3,5-Dimethoxyphenyl isothiocyanate is 3.3.
There are 0 hydrogen bond donor counts in 3,5-Dimethoxyphenyl isothiocyanate.
There are 4 hydrogen bond acceptor counts in 3,5-Dimethoxyphenyl isothiocyanate.