Basic information
- CAS
6943-90-4- Standard SMILES
O=C1C=CC(=O)N1CCc1ccccc1- InChIKey
YDGBGLKCFQULNS-UHFFFAOYSA-N- Molecular formula
- C12H11NO2
- Average molar mass
- 201.22 g/mol
- Monoisotopic mass
- 201.07897859
Names & identifiers
- Preferred name
- Maleimide, N-phenethyl-
- IUPAC
- 1-(2-phenylethyl)pyrrole-2,5-dione
- English name
- 1-phenethylpyrrole-2,5-dione
- Molecular formula
- C12H11NO2
- Molecular weight
- 201.22
Names & synonyms
6943-90-4Maleimide, N-phenethyl-1-(2-phenylethyl)-2,5-dihydro-1H-pyrrole-2,5-dioneDTXSID90287848RefChem:800781DTXCID30238995980-133-71-(2-Phenylethyl)-1H-pyrrole-2,5-dione1-phenethylpyrrole-2,5-dione1-phenethyl-1H-pyrrole-2,5-dione1-(2-phenylethyl)pyrrole-2,5-dioneN-(2-Phenylethyl)maleimide
Show more names
Maleimide-Related Compound 61-Phenethyl-3-pyrroline-2,5-dione1-(2-phenylethyl)-3-pyrroline-2,5-quinone
1H-Pyrrole-2,5-dione, 1-(2-phenylethyl)-MFCD000225831-Phenethyl-pyrrole-2,5-dione1-(2-phenylethyl)azoline-2,5-dione1H-Pyrrole-2, 1-(2-phenylethyl)-n-phenethylmaleimideNSC52833Cyto7A2
Database identifiers
- CAS
6943-90-4- PubChem CID
- 243296
- DTXSID
DTXSID90287848- ChEMBL
CHEMBL223342- EC Number
- 980-133-7
- Nikkaji
- J99.702A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Melting point
- 111.5 · 111.5-112.5 °C
- Boiling point
- 354.3 · 354.3±21.0 °C(Predicted)
- Density
- 1.224 · 1.224±0.06 g/cm3(Predicted)
- pka
- -2.27 · -2.27±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
Suppliers15 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
武汉沃格达生物科技有限公司15071299552 · [email protected]
安徽宏瀚研新药业有限公司0551-62626652 19334025048 · [email protected]
济南利恒生物科技有限公司0531-18763987518 18763987518 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
南京英士奇生物科技有限公司18727012071 18727012071 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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