N-methyl-4-phenyl-4H-1,2,4-triazol-3-amine hydroiodide
Basic information
- CAS
1423806-13-6- Standard SMILES
CNc1nncn1-c1ccccc1.I- InChIKey
FHNLMRZCEVMISY-UHFFFAOYSA-N- Molecular formula
- C9H11IN4
- Average molar mass
- 302.12 g/mol
- Monoisotopic mass
- 302.00284
Names & identifiers
- Preferred name
- N-methyl-4-phenyl-4H-1,2,4-triazol-3-amine hydroiodide
- IUPAC
- N-methyl-4-phenyl-1,2,4-triazol-3-amine;hydroiodide
- English name
- N-methyl-4-phenyl-4H-1,2,4-triazol-3-amine hydroiodide
- Molecular formula
- C9H11IN4
- Molecular weight
- 302.11491
Names & synonyms
N-methyl-4-phenyl-4H-1,2,4-triazol-3-amine hydroiodide1423806-13-6RefChem:830480972-000-7N-methyl-4-phenyl-1,2,4-triazol-3-amine;hydroiodideAKOS026742604CS-0225372EN300-123595Z1558210052
Database identifiers
- CAS
1423806-13-6- PubChem CID
- 71757763
- EC Number
- 972-000-7
Properties
Computed structural properties
- Topological polar surface area
- 42.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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