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Nitriles & Cyanides

p-Nitrophenylacetonitrile, 98%

SynthesisAvailable on request

Buy p-Nitrophenylacetonitrile, 98% (CAS 555-21-5) from Zemixal. Lab and bulk packs, batch COA, fast global delivery. Packs from 10 g.

Pack sizes
p-Nitrophenylacetonitrile, 98% chemical structure
CAS number555-21-5
FormulaC8H6N2O2
Molar mass162.15 g/mol
Physical formPowder
HS code29269000
Purity98%
InChIKeyPXNJGLAVKOXITN-UHFFFAOYSA-N
IUPAC name2-(4-nitrophenyl)acetonitrile

About p-Nitrophenylacetonitrile, 98%

p-Nitrophenylacetonitrile, 98% sits in our nitriles & Cyanides section and ships worldwide from stock or short lead time. Key data (Synthesis): CAS 555-21-5, formula C8H6N2O2 and molar mass 162.15 g/mol. It is described as yellow to tan powder.

Use cases we see most often

  • Polymer & resin production
  • Enzyme inhibition studies

Storage and safety notes

Physical constants on file: melting point 113-115 °C. It carries the GHS signal word Danger (H301, H302, H311 and H312), so wear gloves and eye protection and work with good ventilation.

Standard pack sizes are 10 g, 50 g, 100 g and 1 kg, and custom quantities are quoted on request. Each lot travels with a batch certificate of analysis and a 16-section SDS. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.

Typical uses

  • Polymer & resin production
  • Enzyme inhibition studies

Applications

Specifications and identifiers

Specifications of p-Nitrophenylacetonitrile, 98%
Product namep-Nitrophenylacetonitrile, 98%
Catalogue numberZX-008778
CAS number555-21-5
IUPAC name2-(4-nitrophenyl)acetonitrile
Molecular formulaC8H6N2O2
Molar mass162.15 g/mol
Exact mass162.0429
GradeSynthesis
Purity / assay98%
Physical formPowder
AppearanceYellow to tan powder
Melting point113-115 °C
XLogP31.4
H-bond donors / acceptors0 / 3
Topological polar surface area69.6 Ų
HS code29269000
InChIKeyPXNJGLAVKOXITN-UHFFFAOYSA-N
SMILESC1=CC(=CC=C1CC#N)[N+](=O)[O-]
PubChem CID68386
Synonyms4-Nitrobenzyl cyanide, 4-Nitrophenylacetonitrile, p-Nitrobenzyl cyanide, Benzeneacetonitrile, 4-nitro-, 4-Nitrobenzeneacetonitrile, p-Nitrobenzylcyanide, Acetonitrile, (p-nitrophenyl)-, (p-Nitrophenyl)acetonitrile, (4-nitrophenyl)acetonitrile, p-Nitrobenzeneacetonitrile, p-Nitro-.alpha.-tolunitrile, 4-Nitrobenzyl nitrile

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS06 Acute toxicity
Acute toxicity
GHS07 Irritant or harmful
Irritant or harmful

Signal word Danger

  • H301Toxic if swallowed
  • H302Harmful if swallowed
  • H311Toxic in contact with skin
  • H312Harmful in contact with skin
  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H331Toxic if inhaled
  • H332Harmful if inhaled
  • H335May cause respiratory irritation

Precautionary statements P261, P262, P264, P264 + P265, P270, P271, P280, P301 + P316, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P316, P317, P319, P321, P330, P332 + P317, P337 + P317, P361 + P364, P362 + P364, P403 + P233, P405, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of p-Nitrophenylacetonitrile, 98%
10 gQuoted on request
50 gQuoted on request
100 gQuoted on request
1 kgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about p-Nitrophenylacetonitrile, 98%

Which CAS number identifies p-Nitrophenylacetonitrile, 98%?
p-Nitrophenylacetonitrile, 98% is registered under CAS 555-21-5. You may also see it listed as 4-Nitrobenzyl cyanide, 4-Nitrophenylacetonitrile, p-Nitrobenzyl cyanide. Our catalogue number for this item is ZX-008778.
What are the formula and molar mass of p-Nitrophenylacetonitrile, 98%?
For p-Nitrophenylacetonitrile, 98%, its formula is C8H6N2O2 and its molar mass is 162.15 g/mol. The systematic (IUPAC) name is 2-(4-nitrophenyl)acetonitrile. InChIKey PXNJGLAVKOXITN-UHFFFAOYSA-N lets you match it in any structure database.
What grade and pack sizes are available for p-Nitrophenylacetonitrile, 98%?
This listing is Synthesis grade with 98% purity. Standard packs are 10 g, 50 g, 100 g, 1 kg. Larger quantities and custom packing can be quoted on request.
Which documents come with p-Nitrophenylacetonitrile, 98%?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship p-Nitrophenylacetonitrile, 98% to my country?
Yes. Because p-Nitrophenylacetonitrile, 98% is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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