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nitrobenzene

Also known as: Nitrobenzene, Oil of mirbane, Essence of Mirbane, Nitrobenzen, Nitrobenzeen, Benzene, nitro-

nitrobenzene (CAS 98-95-3) is a compound in the Aromatic Hydrocarbons category listed in the Jingsj chemical database. It has the molecular formula C6H5NO2 and a molecular weight of 123.10900 g/mol. Key properties include a melting point of 5-6 °C(lit.), a boiling point of 210-211 °C(lit.), a density of 1.205 and a flash point of 87.8 °C. It is classified under GHS with signal word Danger and hazard statements H301 — Toxic if swallowed, H311 — Toxic in contact with skin and H331 — Toxic if inhaled. No supplier offers are currently listed; request a quote. Record last updated Nov 2, 2026.

CAS No.
98-95-3
Jingsj CID
J-39266-6
Molecular Formula
C6H5NO2
Molecular Weight
123.10900 g/mol
Category
Aromatic Hydrocarbons
Last updated
11/2/2026

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Physicochemical Properties

Melting Point5-6 °C(lit.)
Boiling Point210-211 °C(lit.)
Density1.205
Flash Point87.8 °C
Exact Mass123.03200
PSA45.82000
LogP2.11800
Additional Property4.2 (vs air)
Vapor Pressure0.15 mm Hg ( 20 °C)
Refractive Indexn20/D 1.551(lit.)
Additional Propertyslightly soluble

GHS Safety & Compliance

Acute Toxicity / Health HazardSignal word: Danger
  • H301 — Toxic if swallowed
  • H311 — Toxic in contact with skin
  • H331 — Toxic if inhaled
  • H351 — Suspected of causing cancer
  • H372 — Causes damage to organs through prolonged exposure
  • H412 — Harmful to aquatic life with long lasting effects

Customs & Trade Information

HS Code2904201000

Frequently Asked Questions

What is the CAS number of nitrobenzene?

The CAS number of nitrobenzene is 98-95-3.

What are the molecular formula and molecular weight of nitrobenzene?

nitrobenzene has molecular formula C6H5NO2 and molecular weight 123.10900 g/mol.

Is nitrobenzene hazardous?

nitrobenzene has GHS signal word Danger and hazard statements H301 — Toxic if swallowed; H311 — Toxic in contact with skin; H331 — Toxic if inhaled.

What are the upstream and downstream products of nitrobenzene?

For nitrobenzene, Upstream Products: 1-Iodo-4-nitrobenzene, Phenylboronic acid, 3-Nitrobenzoic acid; Downstream Products: 4-Nitro-N,N-diphenylaniline, 1-tert-Butyl-4-nitrobenzene, N-tert-butylaniline.

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

Last updated:

How to cite: Jingsj. "nitrobenzene (CAS 98-95-3)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-39266-6 (accessed 2026-11-07).

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