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ChemicalBook--->CAS DataBase List--->701-57-5

701-57-5

701-57-5 Structure

701-57-5 Structure
IdentificationMore
[Name]

4-NITROTHIOANISOLE
[CAS]

701-57-5
[Synonyms]

1-(METHYLTHIO)-4-NITROBENZENE
4-(METHYLTHIO)NITROBENZENE
4-NITROTHIOANISOLE
METHYL-4-NITROPHENYL SULFIDE
P-(METHYLTHIO)NITROBENZENE
1-(Methylsulfanyl)-4-nitrobenzene
Benzene, 1-(methylthio)-4-nitro-
METHYL4-NITROPHENYLSULFIDE,TECH.
p-Nitrothioanisole
4-Nitrothioanisole 98%
Methyl 4-nitrophenylsulphide
4-NITROTHIOANISOLE/METHYL 4-NITROPHENYL SULPHIDE
methyl(4-nitrophenyl)sulfane
p-Nitrophenyl methyl sulfide
1-Nitro-4-(methylthio)benzene
[EINECS(EC#)]

677-868-8
[Molecular Formula]

C7H7NO2S
[MDL Number]

MFCD00010868
[Molecular Weight]

169.2
[MOL File]

701-57-5.mol
Chemical PropertiesBack Directory
[Melting point ]

66-69 °C (lit.) 68-72 °C (lit.)
[Boiling point ]

140 °C / 2mmHg
[density ]

1.2391
[refractive index ]

1.6401 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[Sensitive ]

Stench
[BRN ]

1817928
[CAS DataBase Reference]

701-57-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Methyl 4-nitrophenyl sulphide(701-57-5)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Harmful/Stench
[HazardClass ]

IRRITANT, STENCH
[HS Code ]

29309090
Hazard InformationBack Directory
[Chemical Properties]

Yellow solid
[Uses]

4-Nitrothioanisole may be used to synthesize 4-nitrothioanisole sulfoxide and methyl 4-nitrophenyl sulfoxide.
[Synthesis Reference(s)]

Tetrahedron Letters, 24, p. 2575, 1983 DOI: 10.1016/S0040-4039(00)81985-1
[General Description]

4-Nitrothioanisole in acetone-d6 solution exhibits twofold barrier to rotation about the Csp2-S bond as 16.1±1.5kJ/mol. 4-Nitrothioanisole undergoes hydrogenation in the presence of sulfided Pd/C catalysts.
Spectrum DetailBack Directory
[Spectrum Detail]

4-NITROTHIOANISOLE(701-57-5)1HNMR
4-NITROTHIOANISOLE(701-57-5)IR
4-NITROTHIOANISOLE(701-57-5)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

4-Nitrothioanisole, 98%(701-57-5)
[Sigma Aldrich]

701-57-5(sigmaaldrich)
[TCI AMERICA]

4-Nitrothioanisole,>98.0%(GC)(701-57-5)
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