2-Chloro-3,5,6-triphenylpyrazine
Basic information
- CAS
243472-78-8- Standard SMILES
Clc1nc(-c2ccccc2)c(-c2ccccc2)nc1-c1ccccc1- InChIKey
VTXIJSKJUMZHBW-UHFFFAOYSA-N- Molecular formula
- C22H15ClN2
- Average molar mass
- 342.8 g/mol
- Monoisotopic mass
- 342.0923762
Names & identifiers
- Preferred name
- 2-Chloro-3,5,6-triphenylpyrazine
- IUPAC
- 2-chloro-3,5,6-triphenylpyrazine
- English name
- 2-Chloro-3,5,6-triphenylpyrazine
- Molecular formula
- C22H15ClN2
- Molecular weight
- 342.82
Names & synonyms
2-chloro-3,5,6-triphenylpyrazine243472-78-8RefChem:468593837-459-9NSC716057SCHEMBL23430737SCHEMBL30838817NSC-716057AC-907/25005357Pyrazine, 2-chloro-3,5,6-triphenyl-
Database identifiers
- CAS
243472-78-8- PubChem CID
- 402190
- EC Number
- 837-459-9
- Nikkaji
- J1.175.401E
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 397
Physicochemical properties
- Boiling point
- 442.6 · 442.6±40.0 °C(Predicted)
- Density
- 1.208 · 1.208±0.06 g/cm3(Predicted)
- pka
- -2.84 · -2.84±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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