Basic information
- CAS
6784-62-9- Standard SMILES
CC(=O)Cc1cnccn1- InChIKey
HKVMSCXHSSBGRU-UHFFFAOYSA-N- Molecular formula
- C7H8N2O
- Average molar mass
- 136.15 g/mol
- Monoisotopic mass
- 136.06366288
Names & identifiers
- Preferred name
- 1-(Pyrazin-2-yl)propan-2-one
- IUPAC
- 1-pyrazin-2-ylpropan-2-one
- English name
- 1-Pyrazin-2-yl-propan-2-one
- Molecular formula
- C7H8N2O
- Molecular weight
- 136.15
Names & synonyms
1-(pyrazin-2-yl)propan-2-one6784-62-91-pyrazin-2-ylpropan-2-one1-pyrazin-2-ylacetonePyrazine, acetonylMFCD085721862-Propanone, 1-pyrazinyl-Acetonylprazine1-PYRAZIN-2-YL-PROPAN-2-ONE1-(2-Pyrazinyl)acetonemethyl pyrazylmethyl ketoneSCHEMBL4086758
Show more names
AKOS P-21236032-acetonyl pyrazine1-(2-pyrazinyl)propan-2-one2-Propanone, 1-(2-pyrazinyl)-1-pyrazin-2-ylacetone(SALTDATA: FREE)
DTXSID10334909HKVMSCXHSSBGRU-UHFFFAOYSA-NALBB-018085AKOS003237456AS-505751-pyrazin-2-yl-propan-2-one, AldrichCPRDB-013472CS-0005365
Database identifiers
- CAS
6784-62-9- PubChem CID
- 522284
- DTXSID
DTXSID10334909
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- LogP
- -0.12 · -0.120 (est)
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-37/38-41
- Safety Statements
- 26 · 26-39
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
- risk_code
- 22-37/38-41
- hazard_code
- Xn
- safety_code
- 26-39
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers13 total
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海彰锐化工科技有限公司021-54880687
上海卡恩医药科技有限公司021-34979681; 17701870669 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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