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3-nitrophenyl isocyanate

Also known as: 1-isocyanato-3-nitrobenzene, 1-isocyanato-3-nitro-benzen, 3-isocyanatonitrobenzene, m-nitrophenyl isocyanate, benzene, 1-isocyanato-3-nitro-, isocyanic acid, m-nitrophenyl ester, MFCD00007220, EINECS 222-025-8

3-nitrophenyl isocyanate (CAS 3320-87-4) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C7H4N2O3 and a molecular weight of 164.11800 g/mol. Key properties include a melting point of 51-52 °C(lit.), a boiling point of 130-131 °C11 mm Hg(lit.), a density of 1.32 g/cm3 and a flash point of >110.0 °C. It is classified under GHS with signal word Danger and hazard statements H302 — Harmful if swallowed, H315 — Causes skin irritation and H319 — Causes serious eye irritation. No supplier offers are currently listed; request a quote. Record last updated Nov 3, 2026.

CAS No.
3320-87-4
Jingsj CID
J-12916-8
Molecular Formula
C7H4N2O3
Molecular Weight
164.11800 g/mol
Category
Organic Acids
Last updated
11/3/2026

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Physicochemical Properties

Melting Point51-52 °C(lit.)
Boiling Point130-131 °C11 mm Hg(lit.)
Density1.32 g/cm3
Flash Point>110.0 °C
Exact Mass164.02200
PSA75.25000
LogP2.08530
Refractive Index1.589

GHS Safety & Compliance

Irritant / Health HazardSignal word: Danger
  • H302 — Harmful if swallowed
  • H315 — Causes skin irritation
  • H319 — Causes serious eye irritation
  • H334 — May cause allergy or asthma symptoms if inhaled
  • H335 — May cause respiratory irritation

Customs & Trade Information

HS Code2929109000
Summary2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Frequently Asked Questions

What is the CAS number of 3-nitrophenyl isocyanate?

The CAS number of 3-nitrophenyl isocyanate is 3320-87-4.

What are the molecular formula and molecular weight of 3-nitrophenyl isocyanate?

3-nitrophenyl isocyanate has molecular formula C7H4N2O3 and molecular weight 164.11800 g/mol.

Is 3-nitrophenyl isocyanate hazardous?

3-nitrophenyl isocyanate has GHS signal word Danger and hazard statements H302 — Harmful if swallowed; H315 — Causes skin irritation; H319 — Causes serious eye irritation.

What are the upstream and downstream products of 3-nitrophenyl isocyanate?

For 3-nitrophenyl isocyanate, Upstream Products: Bis(trichloromethyl) carbonate, 3-Nitroaniline, 1,3-Dinitrobenzene; Downstream Products: 3-nitrophenyl isothiocyanate, Benzoic anhydride, tert-Butyl N-(3-aminophenyl)carbamate.

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

Last updated:

How to cite: Jingsj. "3-nitrophenyl isocyanate (CAS 3320-87-4)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-12916-8 (accessed 2026-11-09).

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