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3-Ethynylbenzonitrile

Also known as: 3-Cyanoethynylbenzene, 3-Cyanophenylacetylene, 3-ETHYNYL-BENZONITRILE, 3-Ethynylbenzonitrile 99%, 3-cyanophenylacetylene, 3-ethynyl-benzonitrile, Benzonitrile, 3-ethynyl-, Benzonitrile, 3-ethynyl- (9CI), m-cyanophenylacetylene, 3-CNC6H4CCH

3-Ethynylbenzonitrile (CAS 171290-53-2) is a compound in the Aromatic Hydrocarbons category listed in the Jingsj chemical database. It has the molecular formula C9H5N and a molecular weight of 127.143 g/mol. Key properties include a melting point of 42-45°C, a boiling point of 223.4±23.0 °C at 760 mmHg, a density of 1.1±0.1 g/cm3 and a flash point of 88.7±15.1 °C. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
171290-53-2
Jingsj CID
J-1382674-9
Molecular Formula
C9H5N
Molecular Weight
127.143 g/mol
Category
Aromatic Hydrocarbons
Last updated
8/21/2026

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Physicochemical Properties

Melting Point42-45°C
Boiling Point223.4±23.0 °C at 760 mmHg
Density1.1±0.1 g/cm3
Flash Point88.7±15.1 °C
Exact Mass127.042198
PSA23.79000
LogP1.84
Vapor Pressure0.1±0.4 mmHg at 25°C
Refractive Index1.566

Frequently Asked Questions

What is the CAS number of 3-Ethynylbenzonitrile?

The CAS number of 3-Ethynylbenzonitrile is 171290-53-2.

What are the molecular formula and molecular weight of 3-Ethynylbenzonitrile?

3-Ethynylbenzonitrile has molecular formula C9H5N and molecular weight 127.143 g/mol.

What are the upstream and downstream products of 3-Ethynylbenzonitrile?

For 3-Ethynylbenzonitrile, Upstream Products: 3-[(Trimethylsilyl)ethynyl]benzonitrile, 3-Cyanobenzaldehyde, Dimethyl (1-diazo-2-oxopropyl)phosphonate; Downstream Products: 3-(1H-1,2,3-triazol-4-yl)benzonitrile.

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-Ethynylbenzonitrile (CAS 171290-53-2)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1382674-9 (accessed 2026-11-09).

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