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Isobutyl nitrite

Also known as: 2-methylpropyl nitrite, Nitrous acid, 2-methylpropyl ester, Isobutylnitrite, isobutyl nitrite, EINECS 208-819-7, MFCD00002056

Isobutyl nitrite (CAS 542-56-3) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C4H9NO2 and a molecular weight of 103.120 g/mol. Key properties include a boiling point of 70.5±9.0 °C at 760 mmHg, a density of 1.0±0.1 g/cm3 and a flash point of -21.1±0.0 °C. It is classified under GHS with signal word Danger and hazard statements H225 — Highly flammable liquid and vapour, H302 — Harmful if swallowed and H332 — Harmful if inhaled. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
542-56-3
Jingsj CID
J-1108227-2
Molecular Formula
C4H9NO2
Molecular Weight
103.120 g/mol
Category
Organic Acids
Last updated
8/21/2026

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Physicochemical Properties

Boiling Point70.5±9.0 °C at 760 mmHg
Density1.0±0.1 g/cm3
Flash Point-21.1±0.0 °C
Exact Mass103.063332
PSA38.66000
LogP1.92
Vapor Pressure140.0±0.1 mmHg at 25°C
Refractive Index1.416
Additional Property<0.1 g/100 mL (19 ºC)

GHS Safety & Compliance

Flammable / Irritant / Health HazardSignal word: Danger
  • H225 — Highly flammable liquid and vapour
  • H302 — Harmful if swallowed
  • H332 — Harmful if inhaled
  • H341 — Suspected of causing genetic defects
  • H350 — May cause cancer

Customs & Trade Information

HS Code2920909090
Summary2920909090 esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and their salts; their halogenated, sulphonated, nitrated or nitrosated derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Frequently Asked Questions

What is the CAS number of Isobutyl nitrite?

The CAS number of Isobutyl nitrite is 542-56-3.

What are the molecular formula and molecular weight of Isobutyl nitrite?

Isobutyl nitrite has molecular formula C4H9NO2 and molecular weight 103.120 g/mol.

Is Isobutyl nitrite hazardous?

Isobutyl nitrite has GHS signal word Danger and hazard statements H225 — Highly flammable liquid and vapour; H302 — Harmful if swallowed; H332 — Harmful if inhaled.

What are the upstream and downstream products of Isobutyl nitrite?

For Isobutyl nitrite, Upstream Products: 2-Methyl-1-propanol, 1-Iodo-2-methylpropane, 1-Bromo-2-methylpropane; Downstream Products: 3-Bromo-4-fluorotoluene, 2-Methyl-1-propanol, 2-Methyl-1-nitropropane.

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

Last updated:

How to cite: Jingsj. "Isobutyl nitrite (CAS 542-56-3)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1108227-2 (accessed 2026-11-09).

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