4-isocyanatobenzyl cyanide

4-异氰酸基苯乙腈

Also known as: 2-(4-isocyanatophenyl)acetonitrile, Benzeneacetonitrile, 4-isocyanato-, Benzeneacetonitrile, 4-isocyanato- (9CI), p-cyanomethylphenyl isocyanate, MFCD03701598

4-isocyanatobenzyl cyanide (CAS 59513-89-2) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C9H6N2O and a molecular weight of 158.15700 g/mol. It is also known as 2-(4-isocyanatophenyl)acetonitrile, Benzeneacetonitrile, 4-isocyanato- and Benzeneacetonitrile, 4-isocyanato- (9CI). Key properties include a melting point of 38-42ºC(lit.), a boiling point of 287.2ºC at 760 mmHg, a density of 1.07g/cm3 and a flash point of 220 °F. GHS signal word: Danger. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
59513-89-2
Jingsj CID
J-34305-5
Molecular Formula
C9H6N2O
Chinese Name
4-异氰酸基苯乙腈
Molecular Weight
158.15700 g/mol
Category
Organic Acids
Last updated
8/21/2026

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Physicochemical Properties

Melting Point38-42ºC(lit.)
Boiling Point287.2ºC at 760 mmHg
Density1.07g/cm3
Flash Point220 °F

GHS Safety & Compliance

Irritant / Health HazardSignal word: Danger

Frequently Asked Questions

What is the CAS number of 4-isocyanatobenzyl cyanide?

The CAS number of 4-isocyanatobenzyl cyanide is 59513-89-2.

What are the molecular formula and molecular weight of 4-isocyanatobenzyl cyanide?

4-isocyanatobenzyl cyanide has molecular formula C9H6N2O and molecular weight 158.15700 g/mol.

Is 4-isocyanatobenzyl cyanide hazardous?

4-isocyanatobenzyl cyanide has GHS signal word Danger.

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

Last updated:

How to cite: Jingsj. "4-isocyanatobenzyl cyanide (CAS 59513-89-2)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-34305-5 (accessed 2026-10-24).

Data for reference only; verify specifications, grades and regulatory status with suppliers before purchase.