Basic information
- CAS
6705-23-3- Standard SMILES
c1cnc(N2CCCCC2)cn1- InChIKey
FMPQINQOBNERLC-UHFFFAOYSA-N- Molecular formula
- C9H13N3
- Average molar mass
- 163.22 g/mol
- Monoisotopic mass
- 163.11094743
Names & identifiers
- Preferred name
- 2-(Piperidin-1-yl)pyrazine
- IUPAC
- 2-piperidin-1-ylpyrazine
- English name
- 2-(piperidin-1-yl)pyrazine
- Molecular formula
- C9H13N3
- Molecular weight
- 163.22
Names & synonyms
2-(piperidin-1-yl)pyrazine6705-23-3DTXSID00296547RefChem:254624DTXCID50247685871-677-5NSC1098602-(1-Piperidyl)pyrazineSCHEMBL468382SCHEMBL1266496SCHEMBL2646639SCHEMBL5202906
Show more names
Pyrazine, 2-(1-piperidinyl)-
SCHEMBL12615251SCHEMBL30785422FMPQINQOBNERLC-UHFFFAOYSA-NAKOS040732046NSC-109860DS-003237G58125EN300-7967302
Database identifiers
- CAS
6705-23-3- PubChem CID
- 269231
- DTXSID
DTXSID00296547- EC Number
- 871-677-5
- Nikkaji
- J1.674.541C
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 29 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Boiling point
- 288.9 · 288.9±20.0 °C(predicted)
- Density
- 1.101 · 1.101±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
- pka
- 4.62 · 4.62±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H302-H315-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-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
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
- H335-H302-H315-H319
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
南京世洲生物科技有限公司13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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