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2-(Methylsulfanyl)Benzyl (4-Methylphenyl)Carbamate
[CAS# 338968-11-9]

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Identification
Name 2-(Methylsulfanyl)Benzyl (4-Methylphenyl)Carbamate
Synonyms 2-(methylsulfanyl)benzyl N-(4-methylphenyl)carbamate; 2-(methylthio)benzyl p-tolylcarbamate; MFCD00974939
Molecular Structure CAS#: 338968-11-9, 2-(Methylsulfanyl)Benzyl (4-Methylphenyl)Carbamate
Molecular Formula C16H17NO2S
Molecular Weight 287.38
CAS Registry Number 338968-11-9
SMILES O=C(OCc1ccccc1SC)Nc2ccc(cc2)C
InChI 1S/C16H17NO2S/c1-12-7-9-14(10-8-12)17-16(18)19-11-13-5-3-4-6-15(13)20-2/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey FQRCBJDYEOKREQ-UHFFFAOYSA-N
Properties
Density 1.198g/cm3 (Cal.)
Melting point 107-109°C (Expl.)
Boiling point 397.819°C at 760 mmHg (Cal.)
Flash point 194.394°C (Cal.)
Refractive index 1.613 (Cal.)
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