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1-Iodo-3-nitrobenzene

Also known as: 3-iodonitrobenzene, m-iodonitrobenzene, m-nitrophenyl iodide, 3-nitrophenyl iodide, meta-iodonitrobenzene, meta-nitroiodobenzene, 1-iodo-3-nitro-benzene, 3-nitroiodobenzene

1-Iodo-3-nitrobenzene (CAS 645-00-1) is a compound in the Aromatic Hydrocarbons category listed in the Jingsj chemical database. It has the molecular formula C6H4INO2 and a molecular weight of 249.006 g/mol. Key properties include a melting point of 36-38 °C(lit.), a boiling point of 280.8±13.0 °C at 760 mmHg, a density of 2.0±0.1 g/cm3 and a flash point of 71.7±0.0 °C. It is classified under GHS with signal word Danger and hazard statements H228, H302 — Harmful if swallowed and H312 — Harmful in contact with skin. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
645-00-1
Jingsj CID
J-1965945-1
Molecular Formula
C6H4INO2
Molecular Weight
249.006 g/mol
Category
Aromatic Hydrocarbons
Last updated
8/21/2026

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Physicochemical Properties

Melting Point36-38 °C(lit.)
Boiling Point280.8±13.0 °C at 760 mmHg
Density2.0±0.1 g/cm3
Flash Point71.7±0.0 °C
Exact Mass248.928665
PSA45.82000
LogP2.94
Vapor Pressure0.0±0.6 mmHg at 25°C
Refractive Index1.663
Additional Propertyinsoluble

GHS Safety & Compliance

Flammable / IrritantSignal word: Danger
  • H228
  • H302 — Harmful if swallowed
  • H312 — Harmful in contact with skin
  • H332 — Harmful if inhaled
  • H315 — Causes skin irritation
  • H319 — Causes serious eye irritation
  • H335 — May cause respiratory irritation

Customs & Trade Information

HS Code2904909090
SummaryHS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Frequently Asked Questions

What is the CAS number of 1-Iodo-3-nitrobenzene?

The CAS number of 1-Iodo-3-nitrobenzene is 645-00-1.

What are the molecular formula and molecular weight of 1-Iodo-3-nitrobenzene?

1-Iodo-3-nitrobenzene has molecular formula C6H4INO2 and molecular weight 249.006 g/mol.

Is 1-Iodo-3-nitrobenzene hazardous?

1-Iodo-3-nitrobenzene has GHS signal word Danger and hazard statements H228; H302 — Harmful if swallowed; H312 — Harmful in contact with skin.

What are the upstream and downstream products of 1-Iodo-3-nitrobenzene?

For 1-Iodo-3-nitrobenzene, Upstream Products: 3-Nitrophenylboronic acid, 3-Nitroaniline, 4,4,5,5-Tetramethyl-2-(3-nitrophenyl)-1,3,2-dioxaborolane; Downstream Products: 3-[(Trimethylsilyl)ethynyl]aniline, Ethyl 3-nitrocinnamate, 3-(3-Nitrophenyl)pyridine.

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

Last updated:

How to cite: Jingsj. "1-Iodo-3-nitrobenzene (CAS 645-00-1)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1965945-1 (accessed 2026-11-09).

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