Alliin
Also known as: (±)-Alliin, DL-Alliin, S-Allyl-L-cysteine sulfoxide, 3-(Allylsulfinyl)-L-alanine, (±)-L-Alliin, ACSO, rac-Alliin, L-Alanine, 3-(2-propenylsulfinyl)-
Alliin (CAS 17795-26-5) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C6H11NO3S and a molecular weight of 177.221 g/mol. Key properties include a boiling point of 416.1±45.0 °C at 760 mmHg, a density of 1.4±0.1 g/cm3 and a flash point of 205.5±28.7 °C. It is classified under GHS with signal word Warning and hazard statements H315 — Causes skin irritation, H319 — Causes serious eye irritation and H335 — May cause respiratory irritation. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.
- CAS No.
- 17795-26-5
- Jingsj CID
- J-1966145-2
- Molecular Formula
- C6H11NO3S
- Molecular Weight
- 177.221 g/mol
- Category
- Organic Acids
- Last updated
- 8/21/2026
No offers for this compound yet.
Request a quotePhysicochemical Properties
| Boiling Point | 416.1±45.0 °C at 760 mmHg |
|---|---|
| Density | 1.4±0.1 g/cm3 |
| Flash Point | 205.5±28.7 °C |
| Exact Mass | 177.045959 |
| PSA | 99.60000 |
| LogP | -0.48 |
| Vapor Pressure | 0.0±2.1 mmHg at 25°C |
| Refractive Index | 1.579 |
| Storage Conditions | 2-8°C |
GHS Safety & Compliance
- H315 — Causes skin irritation
- H319 — Causes serious eye irritation
- H335 — May cause respiratory irritation
Activity & Biological Data
| Additional Information | [1]. Bijun Cheng, et al. Discovery of Alliin as a Putative Inhibitor of the Main Protease of SARS-CoV-2 by Molecular Docking. Biotechniques |
|---|
Frequently Asked Questions
What is the CAS number of Alliin?
The CAS number of Alliin is 17795-26-5.
What are the molecular formula and molecular weight of Alliin?
Alliin has molecular formula C6H11NO3S and molecular weight 177.221 g/mol.
Is Alliin hazardous?
Alliin has GHS signal word Warning and hazard statements H315 — Causes skin irritation; H319 — Causes serious eye irritation; H335 — May cause respiratory irritation.
Data compiled from public chemical databases such as PubChem and supplier catalogs; supplier offers are provided by suppliers.
Last updated:
How to cite: Jingsj. "Alliin (CAS 17795-26-5)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1966145-2 (accessed 2026-11-07).
Data for reference only; verify product details with suppliers before purchase.