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4-NITROPHENYL ISOTHIOCYANATE

4-NITROPHENYL ISOTHIOCYANATE Structure
4-NITROPHENYL ISOTHIOCYANATE
  • CAS No.2131-61-5
  • Chemical Name:4-NITROPHENYL ISOTHIOCYANATE
  • CBNumber:CB1110913
  • Molecular Formula:C7H4N2O2S
  • Formula Weight:180.18
  • MOL File:2131-61-5.mol
4-NITROPHENYL ISOTHIOCYANATE Property
  • Melting point 110-112 °C(lit.)
  • Boiling point 137-138 °C11 mm Hg(lit.)
  • Density 1.4360 (rough estimate)
  • refractive index 1.6000 (estimate)
  • Flash point 137-138°C/11mm
  • storage temp. Store at <= 20°C.
  • solubility Very slightly soluble in alcohol and oils.
  • form powder to crystal
  • color Light orange to Yellow to Green
  • Odor Pungent-sweet herbaceous-spicy odor with resemblance to Bitter-almond and remote similarity to Heliotropine.
  • Water Solubility It hydrolyzes with water. Soluble in toluene.
  • Sensitive Moisture Sensitive
  • BRN 640027
  • InChIKey NXHSSIGRWJENBH-UHFFFAOYSA-N
  • CAS DataBase Reference 2131-61-5(CAS DataBase Reference)
  • EPA Substance Registry System Benzene, 1-isothiocyanato-4-nitro- (2131-61-5)
  • UNSPSC Code 12352100
  • NACRES NA.22
Safety
  • Hazard Codes  :Xn
  • Risk Statements  :36/37/38-42
  • Safety Statements  :22-26-36
  • RIDADR  :2811
  • WGK Germany  :3
  • F  :10-21
  • TSCA  :Yes
  • HazardClass  :6.1(b)
  • PackingGroup  :III
  • HS Code  :29309090
  • NFPA 704:
    1
    2 0
Hazard and Precautionary Statements (GHS)
  • Symbol(GHS)
  • Signal wordDanger
  • Hazard statements H315-H317-H319-H334-H335
  • Precautionary statements P280-P302+P352-P305+P351+P338
4-NITROPHENYL ISOTHIOCYANATE Price More Price(7)
  • Brand: Sigma-Aldrich(India)
  • Product number: 283541
  • Product name : 4-Nitrophenyl isothiocyanate
  • Purity: 98%
  • Packaging: 5G
  • Price: ₹2944.4
  • Updated: 2022/06/14
  • Buy: Buy
  • Brand: Sigma-Aldrich(India)
  • Product number: 283541
  • Product name : 4-Nitrophenyl isothiocyanate
  • Purity: 98%
  • Packaging: 25G
  • Price: ₹8660
  • Updated: 2022/06/14
  • Buy: Buy
  • Brand: TCI Chemicals (India)
  • Product number: N0826
  • Product name : 4-Nitrophenyl Isothiocyanate
  • Purity: min. 99.0 %
  • Packaging: 5G
  • Price: ₹4700
  • Updated: 2022/05/26
  • Buy: Buy
  • Brand: ALFA India
  • Product number: ALF-L11042-30
  • Product name : 4-Nitrophenyl isothiocyanate, 97%
  • Purity: 
  • Packaging: 250g
  • Price: ₹22226
  • Updated: 2022/05/26
  • Buy: Buy
  • Brand: ALFA India
  • Product number: ALF-L11042-18
  • Product name : 4-Nitrophenyl isothiocyanate, 97%
  • Purity: 
  • Packaging: 50g
  • Price: ₹11298
  • Updated: 2022/05/26
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4-NITROPHENYL ISOTHIOCYANATE Chemical Properties,Usage,Production

  • Chemical Properties yellow crystalline powder
  • Uses 4-Nitrophenyl isothiocyanate has been used in the synthesis of:
    • 5,6-dimethyl-2-[(4-nitrophenyl)amino]thieno[2,3-d]pyrimidin-4(3H)-one
    • 4,5-dimethyl-2-substituted carbamothioylaminothiophene-3-carboxamides
    • acyclic triazene or zwitterionic dihydropyrimidinium imidothiolate derivatives
  • Uses 4-Nitrophenyl isothiocyanate is used as specializing in synthesizing of organic fine chemicals and pharmaceutical intermediates for use in development and production
  • Production Methods 4-nitrophenyl isothiocyanat can be produced from para-Nitroaniline with Thiophosgene, or from para-Nitrothiocarbanilide by heating with diluted sulfuric acid.
  • Synthesis Reference(s) The Journal of Organic Chemistry, 37, p. 1360, 1972 DOI: 10.1021/jo00974a016
  • General Description The solid-state reactivity of hydrazine hydrochloride with 4-nitrophenyl isothiocyanate was studied.
4-NITROPHENYL ISOTHIOCYANATE Preparation Products And Raw materials
Raw materials
Preparation Products
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4-NITROPHENYL ISOTHIOCYANATE Spectrum
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