Basic information
- CAS
17398-16-2- Standard SMILES
CCc1nc(C)c(C)nc1C- InChIKey
FPOLJKZKOKXIFE-UHFFFAOYSA-N- Molecular formula
- C9H14N2
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.11569846
Overview
Ethyltrimethylpyrazine is a member of pyrazines.
Names & identifiers
- Preferred name
- 2-Ethyl-3,5,6-trimethylpyrazine
- IUPAC
- 2-ethyl-3,5,6-trimethylpyrazine
- English name
- Pyrazine, ethyltrimethyl- (8CI,9CI)
- Molecular formula
- C9H14N2
- Molecular weight
- 150.22
Names & synonyms
2-ETHYL-3,5,6-TRIMETHYLPYRAZINE17398-16-2Ethyltrimethylpyrazine2,3,5-Trimethyl-6-ethylpyrazinePyrazine, ethyltrimethyl-Pyrazine, 2-ethyl-3,5,6-trimethyl-TrimethylethylpyrazineUNII-HGS2G1S1XY2,3,6-Trimethyl-5-ethylpyrazineHGS2G1S1XYPyrazine, ethyltrimethylDTXSID10169738
Show more names
ETHYLTRIMETHYL-PYRAZINE2-Ethyl-3,5,6-trimethylpyrazine (Standard)
6-Ethyl-2,3,5-trimethylpyrazineRefChem:86881DTXCID2092229FPOLJKZKOKXIFE-UHFFFAOYSA-NMFCD08457808Pyrazine, ethyltrimethyl- (8CI,9CI)orb3026061orb3029123
Database identifiers
- CAS
17398-16-2- PubChem CID
- 28518
- DTXSID
DTXSID10169738- ChEBI
CHEBI:213093- UNII
- HGS2G1S1XY
- Nikkaji
- J532.774A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Boiling point
- 85 · 85-90 °C(Press: 10 Torr)
- Density
- 0.953 · 0.953±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 2.93 · 2.93±0.10(Predicted)
- LogP
- 1.717 · 1.717 (est)
- FDA UNII
- 2 G1S1XY · HGS2G1S1XY
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers26 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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