Basic information
- Standard SMILES
[14CH3]C#N- InChIKey
WEVYAHXRMPXWCK-NJFSPNSNSA-N- Molecular formula
- C2H3N
- Average molar mass
- 43.045 g/mol
Names & identifiers
- Preferred name
- CID 16212008
- IUPAC
- acetonitrile
- English name
- Acetonitrile, [2-14C]
- Molecular formula
- C2H3N
- Molecular weight
- 43.04
Names & synonyms
Acetonitrile, [2-14C]
Database identifiers
- CAS
7183-57-5
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 3
- Formal charge
- 0
- Complexity
- 29.3
Physicochemical properties
- Boiling point
- 76 · 76-100 °C
- Flash point
- 2 °C · 2 °C
- storage temp.
- 2 · 2-8°C
- Solvent
- Neat liquid in sealed ampoule
- Specific Activity
- 5 · 5-10 mCi/mmol
- Hazard Codes
- F,T,R
- Risk Statements
- 11 · 11-23/24/25-36/37/38
- Safety Statements
- 16 · 16-26-36/37/39-45
- RIDADR
- 1648 · UN 1648 3/PG 2
- WGK Germany
- 3 · 3
Safety & regulation
Safety data
- wgk
- 3
- ridadr
- UN 1648 3/PG 2
- risk_code
- 11-23/24/25-36/37/38
- hazard_code
- F,T,R
- safety_code
- 16-26-36/37/39-45
Chemistry & industry
Suppliers4 total
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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