Basic information
- CAS
13238-84-1- Standard SMILES
CCc1cnc(CC)cn1- InChIKey
WAVOLMBVDCRBGR-UHFFFAOYSA-N- Molecular formula
- C8H12N2
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.10004839
Overview
2,5-Diethylpyrazine is a member of pyrazines.
Names & identifiers
- Preferred name
- Pyrazine, 2,5-diethyl-
- IUPAC
- 2,5-diethylpyrazine
- English name
- 2,5-Diethylpyrazine
- Molecular formula
- C8H12N2
- Molecular weight
- 136.19
Names & synonyms
2,5-DIETHYLPYRAZINE13238-84-1Pyrazine, 2,5-diethyl-DTXSID30157511RefChem:870420DTXCID8080002603-572-5MFCD066575702,5-diethyl-pyrazineSCHEMBL293667SCHEMBL830188CHEBI:193642
Show more names
femano.--------]2,5-DIETHYPYRAZINE2,5-Diethylpyrazine USP/EP/BP2,5-DIETHYL PYRAZINE FEMA NO.--------
AKOS006292336DB-042106NS00021602Pyrazine, 2,5-diethyl-;; 2,5-diethyl-pyrazineF899594InChI=1/C8H12N2/c1-3-7-5-10-8(4-2)6-9-7/h5-6H,3-4H2,1-2H
Database identifiers
- CAS
13238-84-1- PubChem CID
- 25797
- DTXSID
DTXSID30157511- ChEBI
CHEBI:193642- EC Number
- 603-572-5
- Nikkaji
- J285.823A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 81.3
Experimental & physicochemical properties
Flavoring AgentsEU Flavoring substances
Boiling Point187.00 to 189.00 °C. @ 760.00 mm Hg
Melting Point88.00 °C. @ 760.00 mm Hg
Physicochemical properties
- Boiling point
- 187 · 187-188 °C
- Density
- 0.962 · 0.962±0.06 g/cm3(Predicted)
- FLAVIS Number
- 14.097 · 14.097 | 2,5-Diethylpyrazine
- storage temp.
- 2 · 2-8°C
- pka
- 2.16 · 2.16±0.10(Predicted)
- LogP
- 1.706 · 1.706 (est)
- CAS DataBase Reference
- 13238 · 13238-84-1(CAS DataBase Reference)
- NIST Chemistry Reference
- 2 · Pyrazine, 2,5-diethyl-(13238-84-1)
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, 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
Regulatory Information
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Pyrazine, 2,5-diethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- Hazard statements
- H226
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Upstream & downstream products
Downstream products
Suppliers33 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
白银康寓信生物科技有限公司0943-8293106 · [email protected]
越林试剂021-62960152 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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