1-[4-(Pyrazin-2-yl)phenyl]methanamine dihydrochloride
Basic information
- CAS
1956321-78-0- Standard SMILES
Cl.Cl.NCc1ccc(-c2cnccn2)cc1- InChIKey
AVWNISHPDGULTJ-UHFFFAOYSA-N- Molecular formula
- C11H13Cl2N3
- Average molar mass
- 258.14 g/mol
- Monoisotopic mass
- 257.0486528
Names & identifiers
- Preferred name
- 1-[4-(Pyrazin-2-yl)phenyl]methanamine dihydrochloride
- IUPAC
- (4-pyrazin-2-ylphenyl)methanamine;dihydrochloride
Names & synonyms
1956321-78-01-[4-(pyrazin-2-yl)phenyl]methanamine dihydrochloride1-(4-(pyrazin-2-yl)phenyl)methanamine dihydrochlorideRefChem:424499989-212-0(4-(Pyrazin-2-yl)phenyl)methanamine dihydrochloride(4-(Pyrazin-2-yl)phenyl)methanaminedihydrochloride
Database identifiers
- CAS
1956321-78-0- PubChem CID
- 92135151
- EC Number
- 989-212-0
Properties
Computed structural properties
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 164
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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