5-amino-N-methyl-1H-1,2,3-triazole-4-carboxamide
Basic information
- CAS
22354-03-6- Standard SMILES
CNC(=O)c1n[nH]nc1N- InChIKey
QIRDRQWIQNKHII-UHFFFAOYSA-N- Molecular formula
- C4H7N5O
- Average molar mass
- 141.13 g/mol
- Monoisotopic mass
- 141.06505986
Names & identifiers
- Preferred name
- 5-amino-N-methyl-1H-1,2,3-triazole-4-carboxamide
- IUPAC
- 5-amino-N-methyl-2H-triazole-4-carboxamide
- English name
- 1H-1,2,3-Triazole-4-carboxamide,5-amino-N-methyl-(9CI)
- Molecular formula
- C4H7N5O
- Molecular weight
- 141.13128
Names & synonyms
22354-03-65-Amino-N-methyl-1H-1,2,3-triazole-4-carboxamideRefChem:532409982-457-45-amino-N-methyl-2H-triazole-4-carboxamide4-amino-N-methyl-1H-1,2,3-triazole-5-carboxamide1H-1,2,3-Triazole-4-carboxamide,5-amino-N-methyl-(9CI)SCHEMBL21621343AKOS006338357EN300-224474Z2216711589
Database identifiers
- CAS
22354-03-6- PubChem CID
- 55281185
- EC Number
- 982-457-4
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 138
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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