5-(Aminomethyl)pyrazine-2-carboxylic acid hydrochloride
Basic information
- CAS
2770359-48-1- Standard SMILES
Cl.NCc1cnc(C(=O)O)cn1- InChIKey
JVJYQHQOUPWDAO-UHFFFAOYSA-N- Molecular formula
- C6H8ClN3O2
- Average molar mass
- 189.6 g/mol
- Monoisotopic mass
- 189.0305042
Names & identifiers
- Preferred name
- 5-(Aminomethyl)pyrazine-2-carboxylic acid hydrochloride
- IUPAC
- 5-(aminomethyl)pyrazine-2-carboxylic acid;hydrochloride
Names & synonyms
2770359-48-15-(aminomethyl)pyrazine-2-carboxylic acid hydrochlorideRefChem:530700898-149-75-(aminomethyl)pyrazine-2-carboxylicacidhydrochlorideEN300-208784555-(Aminomethyl)pyrazine-2-carboxylic acid (hydrochloride)
Database identifiers
- CAS
2770359-48-1- PubChem CID
- 165437889
- EC Number
- 898-149-7
Properties
Computed structural properties
- Topological polar surface area
- 89.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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