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Basic information
- CAS
290-96-0- Standard SMILES
c1nncnn1- InChIKey
HTJMXYRLEDBSLT-UHFFFAOYSA-N- Molecular formula
- C2H2N4
- Average molar mass
- 82.06 g/mol
- Monoisotopic mass
- 82.02794608
Names & identifiers
- Preferred name
- 1,2,4,5-Tetrazine
- IUPAC
- 1,2,4,5-tetrazine
- English name
- s-tetrazine
- Molecular formula
- C2H2N4
- Molecular weight
- 82.06
Names & synonyms
1,2,4,5-TETRAZINE290-96-0s-Tetrazinesym-TetrazineCHEBI:39320DTXSID90183194RefChem:71475DTXCID001056851,2,4,5-TetraazineMFCD01682602C2H2N4s-Tetrazine (8CI)
Show more names
SCHEMBL28147SCHEMBL304731,2,4,5-Tetraazine #SCHEMBL3171628CS-M0126SY013765DB-225860F52551
Database identifiers
- CAS
290-96-0- PubChem CID
- 9263
- DTXSID
DTXSID90183194- ChEBI
CHEBI:39320- Nikkaji
- J102.105B
Properties
Computed structural propertiesFilling in
- XLogP
- -1.4
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 26
Physicochemical properties
- Melting point
- 99 °C · 99°C
- Boiling point
- 139.87 °C · 139.87°C (rough estimate)
- Density
- 1.1694 · 1.1694 (rough estimate)
- refractive index
- 1.626 · 1.6260 (estimate)
- storage temp.
- Refrigerator, Under inert atmosphere
- solubility
- Chloroform (Sparingly, Heated), Methanol (Slightly, Heated, Sonicated)
- form
- Solid
- pka
- 1.6 · 1.60±0.70(Predicted)
- color
- Light Red to Red
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 1 · 1,2,4,5-Tetrazine (290-96-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-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
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers27 total
韶远科技(上海)有限公司4000665055 · [email protected]
上海皓竹医药科技有限公司18912729622 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
合肥恩立医药科技有限公司0551-66399836 18955197623 · [email protected]
上海堃睿化工科技有限公司+86-021-50935922
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
武汉易谊化学科技有限公司0711-3617768 13308685235 · [email protected]
Related reactions
3 records
Compound notes
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