Basic information
- CAS
26396-57-6- Standard SMILES
O=C1C=CC(=O)N1c1ccc(Cl)cc1Cl- InChIKey
BZUKGARCPDEBLG-UHFFFAOYSA-N- Molecular formula
- C10H5Cl2NO2
- Average molar mass
- 242.05 g/mol
- Monoisotopic mass
- 240.9697338
Names & identifiers
- Preferred name
- 1-(2,4-dichlorophenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
- IUPAC
- 1-(2,4-dichlorophenyl)pyrrole-2,5-dione
- English name
- 1-(2,4-Dichloro-phenyl)-pyrrole-2,5-dione
- Molecular formula
- C10H5Cl2NO2
- Molecular weight
- 242.06
Names & synonyms
1-(2,4-dichlorophenyl)-2,5-dihydro-1H-pyrrole-2,5-dioneRefChem:420415974-682-11-(2,4-dichlorophenyl)-1H-pyrrole-2,5-dione26396-57-61-(2,4-dichlorophenyl)pyrrole-2,5-dione1H-Pyrrole-2,5-dione, 1-(2,4-dichlorophenyl)-MFCD001259001-(2,4-DICHLORO-PHENYL)-PYRROLE-2,5-DIONE1-(2,4-dichlorophenyl)azoline-2,5-dioneASISCHEM S307721-(2,4-Dichlorphenyl)-1H-pyrrole-2,5-dione
Show more names
ART-CHEM-BB B0067161-(2,4-dichlorophenyl)-3-pyrroline-2,5-quinone
NSC52624Cyto8H6AKOS MSC-0062AURORA 13283SCHEMBL5075617CHEMBL4522096DTXSID20949285AKOS B006716
Database identifiers
- CAS
26396-57-6- PubChem CID
- 243249
- DTXSID
DTXSID20949285- ChEMBL
CHEMBL4522096- EC Number
- 974-682-1
- Nikkaji
- J2.367.452A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Boiling point
- 376.6 · 376.6±32.0 °C(Predicted)
- Density
- 1.57 · 1.570±0.06 g/cm3(Predicted)
- pka
- -2.51 · -2.51±0.20(Predicted)
- HazardClass
- IRRITANT
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
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers18 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [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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