4-nitrophenyl methyl sulfide

Modify Date: 2025-08-24 21:46:16

4-nitrophenyl methyl sulfide Structure
4-nitrophenyl methyl sulfide structure
Common Name 4-nitrophenyl methyl sulfide
CAS Number 701-57-5 Molecular Weight 169.201
Density 1.3±0.1 g/cm3 Boiling Point 289.4±23.0 °C at 760 mmHg
Molecular Formula C7H7NO2S Melting Point 66-69 °C(lit.)
MSDS Chinese USA Flash Point 128.8±22.6 °C

 Names

Name 4-Nitrothioanisole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 289.4±23.0 °C at 760 mmHg
Melting Point 66-69 °C(lit.)
Molecular Formula C7H7NO2S
Molecular Weight 169.201
Flash Point 128.8±22.6 °C
Exact Mass 169.019745
PSA 71.12000
LogP 2.69
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.602
InChIKey NEZGPRYOJVPJKL-UHFFFAOYSA-N
SMILES CSc1ccc([N+](=O)[O-])cc1

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xi
Risk Phrases R20/21/22
Safety Phrases S22-S36/37/39
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2930909090

 Synthetic Route

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Articles4

More Articles
The proximate coupling constant, 5 J (H, CH3), and the torsional mobility of the thiomethyl group in some thioanisole derivatives. Schaefer T, et al.

Can. J. Chem. 69(4) , 620-624, (1991)

Catalytic hydrogenation of sulfur-containing nitrobenzene over Pd/C catalysts: In situ sulfidation of Pd/C for the preparation of Pd x S y catalysts. Zhang Q, et al.

Appl. Catal. A Gen. 497 , 17-21, (2015)

Photoelectrochemical reduction of meta-halonitrobenzenes and related species. Robert AW and George WJ.

J. Chem. Soc., Perkin Trans. II 8 , 1673-1677, (1995)

 4-nitrophenyl methyl sulfideBioassay

View more

Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
Name: Antibacterial activity against Staphylococcus aureus ATCC 25923 after 24 hrs by seria...
Source: ChEMBL
Target: Staphylococcus aureus
External Id: CHEMBL964495
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 Synonyms

4-nitrophenyl methyl sulfide
MFCD00010868
1-methylsulfanyl-4-nitrobenzene
Methyl 4-nitrophenyl sulphide
Methyl 4-nitrophenyl sulfide
1-(Methylsulfanyl)-4-nitrobenzene
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