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4-Methyl-3-nitrobenzonitrile

Also known as: 3-Nitro-4-methylbenzonitrile, 3-Nitro-p-tolunitrile, 4-Cyano-2-nitrotoluene, 5-Cyano-2-methylnitrobenzene, 4-Methyl-3-nitrobenzenecarbonitrile, Benzonitrile, 4-methyl-3-nitro-

4-Methyl-3-nitrobenzonitrile (CAS 939-79-7) is a compound in the Aromatic Hydrocarbons category listed in the Jingsj chemical database. It has the molecular formula C8H6N2O2 and a molecular weight of 162.145 g/mol. Key properties include a melting point of 102-106 °C(lit.), a boiling point of 282.0±28.0 °C at 760 mmHg, a density of 1.3±0.1 g/cm3 and a flash point of 124.3±24.0 °C. It is classified under GHS with signal word Warning and hazard statements H315 — Causes skin irritation, H319 — Causes serious eye irritation and H335 — May cause respiratory irritation. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
939-79-7
Jingsj CID
J-1360954-6
Molecular Formula
C8H6N2O2
Molecular Weight
162.145 g/mol
Category
Aromatic Hydrocarbons
Last updated
8/21/2026

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Physicochemical Properties

Melting Point102-106 °C(lit.)
Boiling Point282.0±28.0 °C at 760 mmHg
Density1.3±0.1 g/cm3
Flash Point124.3±24.0 °C
Exact Mass162.042923
PSA69.61000
LogP1.63
Vapor Pressure0.0±0.6 mmHg at 25°C
Refractive Index1.568

GHS Safety & Compliance

IrritantSignal word: Warning
  • H315 — Causes skin irritation
  • H319 — Causes serious eye irritation
  • H335 — May cause respiratory irritation

Customs & Trade Information

HS Code2926909090
SummaryHS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Frequently Asked Questions

What is the CAS number of 4-Methyl-3-nitrobenzonitrile?

The CAS number of 4-Methyl-3-nitrobenzonitrile is 939-79-7.

What are the molecular formula and molecular weight of 4-Methyl-3-nitrobenzonitrile?

4-Methyl-3-nitrobenzonitrile has molecular formula C8H6N2O2 and molecular weight 162.145 g/mol.

Is 4-Methyl-3-nitrobenzonitrile hazardous?

4-Methyl-3-nitrobenzonitrile has GHS signal word Warning and hazard statements H315 — Causes skin irritation; H319 — Causes serious eye irritation; H335 — May cause respiratory irritation.

What are the upstream and downstream products of 4-Methyl-3-nitrobenzonitrile?

For 4-Methyl-3-nitrobenzonitrile, Upstream Products: p-Tolunitrile, 4-Methyl-3-nitrobenzaldehyde, 4-Chloro-2-nitrotoluene; Downstream Products: 3-Hydroxy-4-methylbenzonitrile, 3-Amino-4-methylbenzonitrile, 3-Methoxy-4-methylbenzonitrile.

Data compiled from public chemical databases such as PubChem and supplier catalogs; supplier offers are provided by suppliers.

Last updated:

How to cite: Jingsj. "4-Methyl-3-nitrobenzonitrile (CAS 939-79-7)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1360954-6 (accessed 2026-11-09).

Data for reference only; verify product details with suppliers before purchase.