3-Cyanophenyl isocyanate
3-氰基苯异氰酸酯
Also known as: 3-Isocyanatobenzonitrile, m-Cyanophenyl isocyanate, Benzonitrile, 3-isocyanato-, Isocyanic acid, m-cyanophenyl ester, 3-Cyanophenylisocyanate
3-Cyanophenyl isocyanate (CAS 16413-26-6) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C8H4N2O and a molecular weight of 144.130 g/mol. It is also known as 3-Isocyanatobenzonitrile, m-Cyanophenyl isocyanate and Benzonitrile, 3-isocyanato-. Key properties include a melting point of 51-54 °C(lit.), a boiling point of 246.2±23.0 °C at 760 mmHg, a density of 1.1±0.1 g/cm3 and a flash point of 102.7±22.6 °C. It is classified under GHS with signal word Warning and hazard statements H302 — Harmful if swallowed, H312 — Harmful in contact with skin and H315 — Causes skin irritation. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.
- CAS No.
- 16413-26-6
- Jingsj CID
- J-1062106-6
- Molecular Formula
- C8H4N2O
- Chinese Name
- 3-氰基苯异氰酸酯
- Molecular Weight
- 144.130 g/mol
- Category
- Organic Acids
- Last updated
- 8/21/2026
No offers for this compound yet.
Request a quotePhysicochemical Properties
| Melting Point | 51-54 °C(lit.) |
|---|---|
| Boiling Point | 246.2±23.0 °C at 760 mmHg |
| Density | 1.1±0.1 g/cm3 |
| Flash Point | 102.7±22.6 °C |
| Exact Mass | 144.032364 |
| PSA | 53.22000 |
| LogP | 2.20 |
| Vapor Pressure | 0.0±0.5 mmHg at 25°C |
| Refractive Index | 1.563 |
GHS Safety & Compliance
- H302 — Harmful if swallowed
- H312 — Harmful in contact with skin
- H315 — Causes skin irritation
- H319 — Causes serious eye irritation
- H332 — Harmful if inhaled
- H335 — May cause respiratory irritation
Customs & Trade Information
| HS Code | 2929109000 |
|---|---|
| Summary | 2929109000. 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-Cyanophenyl isocyanate?
The CAS number of 3-Cyanophenyl isocyanate is 16413-26-6.
What are the molecular formula and molecular weight of 3-Cyanophenyl isocyanate?
3-Cyanophenyl isocyanate has molecular formula C8H4N2O and molecular weight 144.130 g/mol.
Is 3-Cyanophenyl isocyanate hazardous?
3-Cyanophenyl isocyanate has GHS signal word Warning and hazard statements H302 — Harmful if swallowed; H312 — Harmful in contact with skin; H315 — Causes skin irritation.
What are the upstream and downstream products of 3-Cyanophenyl isocyanate?
For 3-Cyanophenyl isocyanate, Upstream Products: m-Tolunitrile, 3-Cyanobenzoic acid, 3-Aminobenzonitrile.
Data compiled from public chemical databases and supplier catalogs; supplier offers are provided by suppliers.
Last updated:
How to cite: Jingsj. "3-Cyanophenyl isocyanate (CAS 16413-26-6)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1062106-6 (accessed 2026-10-28).
Data for reference only; verify specifications, grades and regulatory status with suppliers before purchase.